A0A096NUD9_PAPAN Loading...

V-type proton ATPase subunit F

Subunit of the V1 complex of vacuolar(H+)-ATPase (V-ATPase), a multisubunit enzyme composed of a peripheral complex (V1) that hydrolyzes ATP and a membrane integral complex (V0) that translocates protons. V-ATPase is responsible for acidifying and maintaining the pH of intracellular compartments.

AlphaFold DB (A0A663DH14), UniProt , Accession A0A096NUD9, Species PAPAN (Papio anubis, Olive baboon), Gene ATP6V1F, Length 147 aa.

						>A0A096NUD9_PAPAN|A0A096NUD9|ATP6V1F
MAGRGKLIAVIGDEDTVTGFLLGGIGELNKNRHPNFLVVEKDTTINEIEDTFRSLGSVSGSVAEANPSQHDPPLWDEIDSWQFLNRDDIGIILINQYIAEMVRHALDAHQHSIPAVLEIPSKEHPYDAAKDSILRRARGMFTAEDLR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.4	Very low	74.3	Confident	238 Å²	238	83.3 Å²	83.3	100%	1.172	48%	0.482	S	S	*	.				0	111.9	0	-65.4	-73.2	-172.5	0	0	106.6	G3	M1-G3 VanDerWaalsContact C-N 3.27Å; M1-G3 PolarHBondContact O-N 2.69Å
2	A	37.4	Very low	76.3	Confident	117 Å²	117	76.3 Å²	76.3	97%	0.967	44%	0.442	S	S	*	.			trans	-67.4	96.2	169.4	0	0	0	0	0	106.3
3	G	46.8	Very low	77.9	Confident	62 Å²	62	72.2 Å²	72.2	64%	0.639	42%	0.417	S	S	*	.			trans	-66.6	151.7	-163.8	0	0	0	0	0	112.4	M1 G5	M1-G3 VanDerWaalsContact C-N 3.27Å; M1-G3 PolarHBondContact O-N 2.69Å; G3-G5 PolarHBondContact O-N 3.28Å
4	R	62.3	Low	79.4	Confident	218 Å²	218	76.3 Å²	76.3	82%	0.823	43%	0.431	S	S	*	.			trans	-34	133.5	163.5	-122.8	176.9	-177.4	144.8	1.7	110.2	K6	R4-K6 PolarHBondContact O-N 2.79Å
5	G	65.8	Low	80.6	Confident	66 Å²	66	76.7 Å²	76.7	68%	0.68	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-49.8	132.9	174.4	0	0	0	0	0	110	G3	G3-G5 PolarHBondContact O-N 3.28Å
6	K	83.3	Confident	81.6	Confident	115 Å²	115	73.1 Å²	73.1	50%	0.5	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-78.8	143.5	176.3	-66.3	-74.6	-171.1	163.1	0	109.1	R4 D87 D88	R4-K6 PolarHBondContact O-N 2.79Å; K6-D87 PolarHBondContact NZ-O 2.92Å; K6-D88 CarbonylContact C-O 3.52Å; K6-D88 WeakPolarHBondContact CA-O 3.13Å
7	L	92.2	Very high	82.6	Confident	40 Å²	40	68.8 Å²	68.8	21%	0.209	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	163	-178.6	-65.1	157.8	0	0	0	110.9	E27 D88 I89 G90 I91	L7-E27 WeakPolarHBondContact CD1-OE1 3.47Å; L7-E27 VanDerWaalsContact CD1-OE2 3.31Å; L7-E27 WeakPolarHBondContact CD1-OE2 3.44Å; L7-E27 VanDerWaalsContact CD2-OE2 3.25Å; L7-E27 WeakPolarHBondContact CD2-OE2 3.42Å; L7-D88 PolarHBondContact N-O 2.88Å; L7-I89 HydrophobicContact CB-CD1 3.87Å; L7-G90 PolarHBondContact O-N 3.46Å; L7-I91 PolarHBondContact O-N 2.94Å
8	I	94.6	Very high	83.4	Confident	57 Å²	57	68.7 Å²	68.7	29%	0.292	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	137.3	171.9	-57.3	172.4	0	0	0	107.1	I25 N35 I91 L93	I8-I25 HydrophobicContact CB-CD1 4.06Å; I8-I25 HydrophobicContact CB-CG2 3.75Å; I8-I25 HydrophobicContact CD1-CD1 3.97Å; I8-I25 HydrophobicContact CG2-CD1 3.9Å; I8-I25 HydrophobicContact CG2-CG2 4.06Å; I8-I25 WeakPolarHBondContact O-CG2 3.38Å; I8-N35 PolarHBondContact O-ND2 3.04Å; I8-I91 CarbonylContact C-O 3.44Å; I8-I91 WeakPolarHBondContact CA-O 3.32Å; I8-I91 HydrophobicContact CG1-CB 4.37Å; I8-I91 HydrophobicContact CG2-CB 4.44Å; I8-L93 HydrophobicContact CG2-CD1 3.82Å; I8-L93 HydrophobicContact CG2-CG 3.81Å
9	A	96.4	Very high	84.2	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	154.7	171.2	0	0	0	0	0	110.7	N35 L55 I89 I91 I92 L93	A9-N35 CarbonylContact C-O 3.51Å; A9-N35 WeakPolarHBondContact CA-O 3.42Å; A9-N35 HydrophobicContact CB-CB 4.22Å; A9-N35 WeakPolarHBondContact CB-O 3.41Å; A9-L55 HydrophobicContact CB-CB 4.4Å; A9-L55 HydrophobicContact CB-CD1 3.93Å; A9-L55 HydrophobicContact CB-CD2 3.87Å; A9-L55 HydrophobicContact CB-CG 4.28Å; A9-I89 HydrophobicContact CB-CD1 4.04Å; A9-I89 HydrophobicContact CB-CG1 4.34Å; A9-I89 HydrophobicContact CB-CG2 3.89Å; A9-I91 PolarHBondContact N-O 2.95Å; A9-I92 HydrophobicContact CB-CG1 4.24Å; A9-L93 PolarHBondContact O-N 3.22Å
10	V	97.8	Very high	84.8	Confident	3 Å²	3	66.8 Å²	66.8	2%	0.018	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	121.9	-174.8	-172.7	0	0	0	0	111.7	T16 V17 F20 I25 N35 F36 L37 L93	V10-T16 HydrophobicContact CG1-CG2 4.46Å; V10-V17 HydrophobicContact CG1-CG2 4.03Å; V10-F20 HydrophobicContact CG1-CD2 3.75Å; V10-F20 HydrophobicContact CG1-CE2 4.39Å; V10-F20 HydrophobicContact CG1-CG 4.39Å; V10-F20 HydrophobicContact CG2-CB 3.88Å; V10-F20 HydrophobicContact CG2-CD2 4.08Å; V10-F20 HydrophobicContact CG2-CG 3.95Å; V10-I25 HydrophobicContact CG2-CG2 4.11Å; V10-N35 PolarHBondContact N-O 3.49Å; V10-F36 HydrophobicContact CB-CB 4.28Å; V10-F36 CarbonylContact O-C 3.53Å; V10-F36 WeakPolarHBondContact O-CA 3.45Å; V10-F36 WeakPolarHBondContact O-CB 3.38Å; V10-L37 PolarHBondContact O-N 2.68Å; V10-L93 CarbonylContact C-O 3.53Å; V10-L93 WeakPolarHBondContact CA-O 3.33Å; V10-L93 HydrophobicContact CG2-CB 4.44Å; V10-L93 HydrophobicContact CG2-CD1 4.45Å
11	I	97.9	Very high	85.4	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	109.5	169.1	-58.5	174.7	0	0	0	107.3	L37 V39 I48 T51 F52 L55 I92 L93 I94 N95 I98	I11-L37 HydrophobicContact CG1-CB 4.36Å; I11-L37 HydrophobicContact CG2-CB 4.4Å; I11-L37 HydrophobicContact CG2-CD2 4.26Å; I11-V39 HydrophobicContact CG2-CG2 3.9Å; I11-I48 HydrophobicContact CG2-CG2 4.27Å; I11-T51 HydrophobicContact CD1-CG2 4.44Å; I11-F52 HydrophobicContact CD1-CB 3.98Å; I11-F52 HydrophobicContact CD1-CD2 4.33Å; I11-L55 HydrophobicContact CD1-CD1 4.09Å; I11-L55 HydrophobicContact CG1-CD1 4.02Å; I11-I92 HydrophobicContact CD1-CG2 4.43Å; I11-L93 PolarHBondContact N-O 3.43Å; I11-I94 HydrophobicContact CB-CB 4.35Å; I11-I94 HydrophobicContact CB-CD1 4.25Å; I11-I94 HydrophobicContact CB-CG1 4.04Å; I11-I94 HydrophobicContact CD1-CD1 4.43Å; I11-I94 HydrophobicContact CG2-CD1 4.15Å; I11-I94 HydrophobicContact CG2-CG1 4.18Å; I11-I94 VanDerWaalsContact O-CA 3.24Å; I11-I94 WeakPolarHBondContact O-CA 3.41Å; I11-N95 PolarHBondContact O-N 3.07Å; I11-N95 VanDerWaalsContact O-N 3.12Å; I11-I98 HydrophobicContact CG2-CG2 4.11Å
12	G	98.3	Very high	87.9	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	171.7	-171.5	0	0	0	0	0	114.5	L37 V38 V39 N95	G12-L37 PolarHBondContact N-O 2.99Å; G12-V38 CarbonylContact O-C 3.55Å; G12-V38 WeakPolarHBondContact O-CA 3.31Å; G12-V39 PolarHBondContact O-N 2.8Å; G12-N95 WeakPolarHBondContact CA-OD1 3.25Å
13	D	98.1	Very high	90.8	Very high	23 Å²	23	60.2 Å²	60.2	12%	0.123	35%	0.35	C	S	.	.			trans	-63	167	164.2	54.1	35.7	0	0	0	111.7	D15 T16 V17 N95 Y97 S121	D13-D15 VanDerWaalsContact C-N 3.3Å; D13-D15 PolarHBondContact O-N 2.84Å; D13-T16 PolarHBondContact O-N 2.94Å; D13-T16 WeakPolarHBondContact OD1-CB 3.36Å; D13-T16 PolarHBondContact OD1-N 3.43Å; D13-T16 PolarHBondContact OD1-OG1 3.44Å; D13-V17 WeakPolarHBondContact O-CG2 3Å; D13-V17 PolarHBondContact O-N 3.44Å; D13-N95 PolarHBondContact N-OD1 2.91Å; D13-Y97 WeakPolarHBondContact CB-OH 3.33Å; D13-S121 WeakPolarHBondContact OD2-CB 3.27Å; D13-S121 PolarHBondContact OD2-OG 3.07Å
14	E	97.6	Very high	93	Very high	129 Å²	129	60.3 Å²	60.3	60%	0.603	35%	0.351	S	S	*	.	H	α-helix	trans	-51.7	-46.3	-179.8	-172.9	-178.5	179	0	0	112.6	T18 V38	E14-T18 WeakPolarHBondContact O-CB 3.42Å; E14-T18 PolarHBondContact O-N 2.93Å; E14-T18 PolarHBondContact O-OG1 3.35Å; E14-V38 HydrophobicContact CB-CG1 4.15Å
15	D	97.4	Very high	94.4	Very high	83 Å²	83	51.6 Å²	51.6	44%	0.444	32%	0.32	S	S	.	.	H	α-helix	trans	-64.7	-43.9	-179.5	-82.4	-15.4	0	0	0	111.1	D13 G19 K122	D13-D15 VanDerWaalsContact C-N 3.3Å; D13-D15 PolarHBondContact O-N 2.84Å; D15-G19 PolarHBondContact O-N 2.91Å; D15-G19 VanDerWaalsContact O-N 3.12Å; D15-K122 WeakPolarHBondContact OD2-CD 3.28Å; D15-K122 IonicContact OD2-NZ 3.97Å; D15-K122 PolarHBondContact OD2-NZ 3.25Å
16	T	97.9	Very high	95.6	Very high	18 Å²	18	50.3 Å²	50.3	11%	0.11	31%	0.307	C	S	.	.	H	α-helix	trans	-64.4	-52.6	178.8	-61	0	0	0	0	111.3	V10 D13 T18 G19 F20 N95 I119	V10-T16 HydrophobicContact CG1-CG2 4.46Å; D13-T16 PolarHBondContact O-N 2.94Å; D13-T16 WeakPolarHBondContact OD1-CB 3.36Å; D13-T16 PolarHBondContact OD1-N 3.43Å; D13-T16 PolarHBondContact OD1-OG1 3.44Å; T16-T18 VanDerWaalsContact C-N 3.35Å; T16-T18 PolarHBondContact O-N 2.73Å; T16-G19 PolarHBondContact O-N 3.08Å; T16-F20 HydrophobicContact CG2-CD2 3.92Å; T16-F20 HydrophobicContact CG2-CE2 3.76Å; T16-F20 VanDerWaalsContact O-CD2 3.27Å; T16-F20 WeakPolarHBondContact O-CD2 3.5Å; T16-F20 PolarHBondContact O-N 3.2Å; T16-N95 WeakPolarHBondContact CG2-ND2 3.47Å; T16-N95 PolarHBondContact OG1-ND2 2.72Å; T16-N95 PolarHBondContact OG1-OD1 2.98Å; T16-I119 HydrophobicContact CG2-CD1 3.75Å
17	V	97.6	Very high	96.1	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-44	-177.4	173.7	0	0	0	0	110.4	V10 D13 G19 F20 L21 F36 L37 V38	V10-V17 HydrophobicContact CG1-CG2 4.03Å; D13-V17 WeakPolarHBondContact O-CG2 3Å; D13-V17 PolarHBondContact O-N 3.44Å; V17-G19 VanDerWaalsContact C-N 3.3Å; V17-G19 PolarHBondContact O-N 3.49Å; V17-F20 PolarHBondContact O-N 3.19Å; V17-F20 VanDerWaalsContact O-N 3.17Å; V17-L21 HydrophobicContact CG1-CD1 3.82Å; V17-L21 HydrophobicContact CG1-CG 4.04Å; V17-L21 VanDerWaalsContact O-CG 3.3Å; V17-L21 WeakPolarHBondContact O-CG 3.33Å; V17-L21 PolarHBondContact O-N 2.99Å; V17-F36 HydrophobicContact CG1-CB 4.26Å; V17-F36 HydrophobicContact CG1-CD2 3.73Å; V17-F36 HydrophobicContact CG1-CE2 4.44Å; V17-F36 HydrophobicContact CG1-CG 4.19Å; V17-L37 WeakPolarHBondContact CG2-O 3.25Å; V17-V38 HydrophobicContact CB-CG2 3.92Å; V17-V38 HydrophobicContact CG1-CG2 3.67Å; V17-V38 HydrophobicContact CG2-CG2 4.14Å
18	T	97.4	Very high	95.8	Very high	66 Å²	66	51.1 Å²	51.1	41%	0.405	32%	0.315	S	S	.	.	H	α-helix	trans	-56.3	-45	176.5	-62.6	0	0	0	0	111.5	E14 T16 F20 L21 L22	E14-T18 WeakPolarHBondContact O-CB 3.42Å; E14-T18 PolarHBondContact O-N 2.93Å; E14-T18 PolarHBondContact O-OG1 3.35Å; T16-T18 VanDerWaalsContact C-N 3.35Å; T16-T18 PolarHBondContact O-N 2.73Å; T18-F20 PolarHBondContact O-N 2.88Å; T18-L21 PolarHBondContact O-N 3.1Å; T18-L22 HydrophobicContact CG2-CD1 4.13Å; T18-L22 HydrophobicContact CG2-CG 4.5Å; T18-L22 WeakPolarHBondContact O-CG 3.28Å; T18-L22 PolarHBondContact O-N 3.42Å
19	G	97.9	Very high	95.4	Very high	41 Å²	41	50.3 Å²	50.3	42%	0.423	31%	0.311	S	S	.	.	H	α-helix	trans	-58.1	-44.6	177.1	0	0	0	0	0	113.2	D15 T16 V17 L22 G23	D15-G19 PolarHBondContact O-N 2.91Å; D15-G19 VanDerWaalsContact O-N 3.12Å; T16-G19 PolarHBondContact O-N 3.08Å; V17-G19 VanDerWaalsContact C-N 3.3Å; V17-G19 PolarHBondContact O-N 3.49Å; G19-L22 PolarHBondContact O-N 2.75Å; G19-G23 PolarHBondContact O-N 2.98Å; G19-G23 VanDerWaalsContact O-N 3.07Å
20	F	97.8	Very high	94.7	Very high	59 Å²	59	59.5 Å²	59.5	26%	0.259	35%	0.351	S	S	.	.	H	α-helix	trans	-72.8	-33.5	178.6	-76.9	-65.6	0	0	0	113.9	V10 T16 V17 T18 G23 G24 I25 L93 I119	V10-F20 HydrophobicContact CG1-CD2 3.75Å; V10-F20 HydrophobicContact CG1-CE2 4.39Å; V10-F20 HydrophobicContact CG1-CG 4.39Å; V10-F20 HydrophobicContact CG2-CB 3.88Å; V10-F20 HydrophobicContact CG2-CD2 4.08Å; V10-F20 HydrophobicContact CG2-CG 3.95Å; T16-F20 HydrophobicContact CG2-CD2 3.92Å; T16-F20 HydrophobicContact CG2-CE2 3.76Å; T16-F20 VanDerWaalsContact O-CD2 3.27Å; T16-F20 WeakPolarHBondContact O-CD2 3.5Å; T16-F20 PolarHBondContact O-N 3.2Å; V17-F20 PolarHBondContact O-N 3.19Å; V17-F20 VanDerWaalsContact O-N 3.17Å; T18-F20 PolarHBondContact O-N 2.88Å; F20-G23 CarbonylContact O-C 3.57Å; F20-G23 WeakPolarHBondContact O-CA 3.42Å; F20-G23 PolarHBondContact O-N 3.33Å; F20-G23 VanDerWaalsContact O-N 3.16Å; F20-G24 PolarHBondContact O-N 3.03Å; F20-I25 HydrophobicContact CB-CD1 4.16Å; F20-I25 HydrophobicContact CD1-CD1 3.39Å; F20-I25 HydrophobicContact CE1-CD1 4.14Å; F20-I25 HydrophobicContact CG-CD1 4.12Å; F20-I25 PolarHBondContact O-N 3.13Å; F20-L93 HydrophobicContact CD1-CD1 4.02Å; F20-L93 HydrophobicContact CD2-CD1 4.49Å; F20-L93 HydrophobicContact CE1-CD1 3.36Å; F20-L93 HydrophobicContact CE2-CD1 3.94Å; F20-L93 HydrophobicContact CZ-CD1 3.32Å; F20-I119 HydrophobicContact CE2-CD1 3.53Å; F20-I119 HydrophobicContact CZ-CD1 3.94Å
21	L	95.7	Very high	94	Very high	68 Å²	68	65.1 Å²	65.1	36%	0.356	38%	0.381	S	S	.	.	H	α-helix	trans	-64.4	-42.6	173.3	-69.3	-180	0	0	0	111.2	V17 T18 G23 G24 F36	V17-L21 HydrophobicContact CG1-CD1 3.82Å; V17-L21 HydrophobicContact CG1-CG 4.04Å; V17-L21 VanDerWaalsContact O-CG 3.3Å; V17-L21 WeakPolarHBondContact O-CG 3.33Å; V17-L21 PolarHBondContact O-N 2.99Å; T18-L21 PolarHBondContact O-N 3.1Å; L21-G23 PolarHBondContact O-N 3.15Å; L21-G24 PolarHBondContact O-N 2.94Å; L21-F36 HydrophobicContact CD1-CD2 4.49Å; L21-F36 HydrophobicContact CD1-CE1 4.5Å; L21-F36 HydrophobicContact CD1-CE2 4.18Å; L21-F36 HydrophobicContact CD1-CZ 4.18Å; L21-F36 HydrophobicContact CD2-CD1 3.72Å; L21-F36 HydrophobicContact CD2-CE1 3.73Å; L21-F36 HydrophobicContact CD2-CG 4.22Å; L21-F36 HydrophobicContact CD2-CZ 4.24Å
22	L	96.8	Very high	93.4	Very high	150 Å²	150	74.8 Å²	74.8	79%	0.785	42%	0.417	S	S	*	.	H	α-helix	trans	-62.6	-30.7	172.1	-69.3	172.7	0	0	0	112.3	T18 G19 G24	T18-L22 HydrophobicContact CG2-CD1 4.13Å; T18-L22 HydrophobicContact CG2-CG 4.5Å; T18-L22 WeakPolarHBondContact O-CG 3.28Å; T18-L22 PolarHBondContact O-N 3.42Å; G19-L22 PolarHBondContact O-N 2.75Å; L22-G24 PolarHBondContact O-N 2.77Å
23	G	96.3	Very high	92.8	Very high	65 Å²	65	79.2 Å²	79.2	67%	0.67	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-6.3	172.4	0	0	0	0	0	115	G19 F20 L21	G19-G23 PolarHBondContact O-N 2.98Å; G19-G23 VanDerWaalsContact O-N 3.07Å; F20-G23 CarbonylContact O-C 3.57Å; F20-G23 WeakPolarHBondContact O-CA 3.42Å; F20-G23 PolarHBondContact O-N 3.33Å; F20-G23 VanDerWaalsContact O-N 3.16Å; L21-G23 PolarHBondContact O-N 3.15Å
24	G	94.1	Very high	92.5	Very high	64 Å²	64	80.7 Å²	80.7	66%	0.66	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.7	17.5	175.6	0	0	0	0	0	115.4	F20 L21 L22	F20-G24 PolarHBondContact O-N 3.03Å; L21-G24 PolarHBondContact O-N 2.94Å; L22-G24 PolarHBondContact O-N 2.77Å
25	I	92.1	Very high	92.3	Very high	35 Å²	35	74.6 Å²	74.6	18%	0.179	42%	0.42	C	S	.	.			trans	-78.7	-26.2	178.8	-65.3	-175.2	0	0	0	112.5	I8 V10 F20 E27 N35	I8-I25 HydrophobicContact CB-CD1 4.06Å; I8-I25 HydrophobicContact CB-CG2 3.75Å; I8-I25 HydrophobicContact CD1-CD1 3.97Å; I8-I25 HydrophobicContact CG2-CD1 3.9Å; I8-I25 HydrophobicContact CG2-CG2 4.06Å; I8-I25 WeakPolarHBondContact O-CG2 3.38Å; V10-I25 HydrophobicContact CG2-CG2 4.11Å; F20-I25 HydrophobicContact CB-CD1 4.16Å; F20-I25 HydrophobicContact CD1-CD1 3.39Å; F20-I25 HydrophobicContact CE1-CD1 4.14Å; F20-I25 HydrophobicContact CG-CD1 4.12Å; F20-I25 PolarHBondContact O-N 3.13Å; I25-E27 PolarHBondContact O-N 3.36Å; I25-N35 PolarHBondContact O-ND2 3.36Å
26	G	90.8	Very high	92.3	Very high	40 Å²	40	73.2 Å²	73.2	41%	0.412	41%	0.41	S	S	.	.			trans	-61.3	124.8	-173.1	0	0	0	0	0	114
27	E	92.5	Very high	92.3	Very high	69 Å²	69	73.3 Å²	73.3	32%	0.322	41%	0.41	S	S	.	.			trans	-139	140.9	175.9	-168.8	-175.6	97.2	0	0	111	L7 I25 P34 N35 R86	L7-E27 WeakPolarHBondContact CD1-OE1 3.47Å; L7-E27 VanDerWaalsContact CD1-OE2 3.31Å; L7-E27 WeakPolarHBondContact CD1-OE2 3.44Å; L7-E27 VanDerWaalsContact CD2-OE2 3.25Å; L7-E27 WeakPolarHBondContact CD2-OE2 3.42Å; I25-E27 PolarHBondContact O-N 3.36Å; E27-P34 WeakPolarHBondContact O-CA 3.36Å; E27-N35 PolarHBondContact N-OD1 2.94Å; E27-N35 PolarHBondContact O-N 2.94Å; E27-N35 VanDerWaalsContact O-N 3.08Å; E27-N35 PolarHBondContact O-OD1 3.08Å; E27-N35 VanDerWaalsContact O-OD1 3.13Å; E27-R86 IonicContact OE1-CZ 3.45Å; E27-R86 IonicContact OE1-NH1 3.69Å; E27-R86 IonicContact OE1-NH2 3.58Å; E27-R86 PolarHBondContact OE1-NH2 3.17Å
28	L	87.8	Confident	92.3	Very high	103 Å²	103	75.3 Å²	75.3	54%	0.539	42%	0.422	S	S	.	.	B	Isolated β-bridge	trans	-102.8	128.5	165.1	-61.8	179.3	0	0	0	109.3	H33 P34	L28-H33 WeakPolarHBondContact CA-O 3.46Å; L28-P34 HydrophobicContact CD2-CB 3.92Å
29	N	84.3	Confident	92.3	Very high	39 Å²	39	72.8 Å²	72.8	21%	0.209	41%	0.406	C	S	.	.			trans	-71.6	179.1	173.2	75.4	14.5	0	0	0	111.5	N31 R32 H33	N29-N31 PolarHBondContact O-N 3.18Å; N29-N31 VanDerWaalsContact O-N 3.08Å; N29-N31 WeakPolarHBondContact OD1-CA 3.45Å; N29-N31 WeakPolarHBondContact OD1-CB 3.27Å; N29-N31 PolarHBondContact OD1-N 3.33Å; N29-R32 WeakPolarHBondContact O-CA 3.43Å; N29-R32 PolarHBondContact O-N 3.46Å; N29-R32 PolarHBondContact OD1-N 2.97Å; N29-H33 PolarHBondContact N-O 3.14Å; N29-H33 PolarHBondContact OD1-N 3.47Å
30	K	83.6	Confident	92.2	Very high	194 Å²	194	76.4 Å²	76.4	84%	0.843	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-26.7	-179.8	-65.3	-178.8	-179.2	177.8	0	114	R32	K30-R32 VanDerWaalsContact C-N 3.3Å
31	N	82.8	Confident	91.9	Very high	120 Å²	120	84 Å²	84	64%	0.642	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	9.7	179.5	-61.3	-23.3	0	0	0	111.9	N29 H33	N29-N31 PolarHBondContact O-N 3.18Å; N29-N31 VanDerWaalsContact O-N 3.08Å; N29-N31 WeakPolarHBondContact OD1-CA 3.45Å; N29-N31 WeakPolarHBondContact OD1-CB 3.27Å; N29-N31 PolarHBondContact OD1-N 3.33Å; N31-H33 VanDerWaalsContact CB-ND1 3.28Å; N31-H33 WeakPolarHBondContact CB-ND1 3.27Å; N31-H33 PolarHBondContact O-N 3.29Å
32	R	84.9	Confident	91.9	Very high	203 Å²	203	86.8 Å²	86.8	77%	0.766	46%	0.46	S	S	*	.			trans	62.8	22	-177.1	-54.4	-178.8	62	177.9	-2	114.6	N29 K30	N29-R32 WeakPolarHBondContact O-CA 3.43Å; N29-R32 PolarHBondContact O-N 3.46Å; N29-R32 PolarHBondContact OD1-N 2.97Å; K30-R32 VanDerWaalsContact C-N 3.3Å
33	H	85.6	Confident	91.8	Very high	94 Å²	94	80.5 Å²	80.5	44%	0.435	43%	0.428	S	S	.	.			trans	-81.9	131.3	170.3	-58.1	97	0	0	0	109.9	L28 N29 N31	L28-H33 WeakPolarHBondContact CA-O 3.46Å; N29-H33 PolarHBondContact N-O 3.14Å; N29-H33 PolarHBondContact OD1-N 3.47Å; N31-H33 VanDerWaalsContact CB-ND1 3.28Å; N31-H33 WeakPolarHBondContact CB-ND1 3.27Å; N31-H33 PolarHBondContact O-N 3.29Å
34	P	92.1	Very high	91.8	Very high	53 Å²	53	81 Å²	81	34%	0.344	42%	0.418	S	S	.	.	B	Isolated β-bridge	trans	-72.4	158.9	176.1	31.7	-34.9	0	0	0	111.8	E27 L28 F36	E27-P34 WeakPolarHBondContact O-CA 3.36Å; L28-P34 HydrophobicContact CD2-CB 3.92Å; P34-F36 HydrophobicContact CB-CD1 3.74Å; P34-F36 HydrophobicContact CB-CE1 3.59Å; P34-F36 HydrophobicContact CB-CE2 4.39Å; P34-F36 HydrophobicContact CB-CG 4.21Å; P34-F36 HydrophobicContact CB-CZ 3.95Å; P34-F36 WeakPolarHBondContact CG-O 3.35Å
35	N	93.6	Very high	91.8	Very high	1 Å²	1	81.8 Å²	81.8	1%	0.005	41%	0.407	C	S	.	.	S	Bend	trans	-88.4	19.5	163.1	62.5	-20.2	0	0	0	112.8	I8 A9 V10 I25 E27 I89	I8-N35 PolarHBondContact O-ND2 3.04Å; A9-N35 CarbonylContact C-O 3.51Å; A9-N35 WeakPolarHBondContact CA-O 3.42Å; A9-N35 HydrophobicContact CB-CB 4.22Å; A9-N35 WeakPolarHBondContact CB-O 3.41Å; V10-N35 PolarHBondContact N-O 3.49Å; I25-N35 PolarHBondContact O-ND2 3.36Å; E27-N35 PolarHBondContact N-OD1 2.94Å; E27-N35 PolarHBondContact O-N 2.94Å; E27-N35 VanDerWaalsContact O-N 3.08Å; E27-N35 PolarHBondContact O-OD1 3.08Å; E27-N35 VanDerWaalsContact O-OD1 3.13Å; N35-I89 HydrophobicContact CB-CD1 4.09Å
36	F	96.6	Very high	91.8	Very high	55 Å²	55	85.3 Å²	85.3	24%	0.241	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	154.9	-179.2	63.3	-89.8	0	0	0	112.3	V10 V17 L21 P34	V10-F36 HydrophobicContact CB-CB 4.28Å; V10-F36 CarbonylContact O-C 3.53Å; V10-F36 WeakPolarHBondContact O-CA 3.45Å; V10-F36 WeakPolarHBondContact O-CB 3.38Å; V17-F36 HydrophobicContact CG1-CB 4.26Å; V17-F36 HydrophobicContact CG1-CD2 3.73Å; V17-F36 HydrophobicContact CG1-CE2 4.44Å; V17-F36 HydrophobicContact CG1-CG 4.19Å; L21-F36 HydrophobicContact CD1-CD2 4.49Å; L21-F36 HydrophobicContact CD1-CE1 4.5Å; L21-F36 HydrophobicContact CD1-CE2 4.18Å; L21-F36 HydrophobicContact CD1-CZ 4.18Å; L21-F36 HydrophobicContact CD2-CD1 3.72Å; L21-F36 HydrophobicContact CD2-CE1 3.73Å; L21-F36 HydrophobicContact CD2-CG 4.22Å; L21-F36 HydrophobicContact CD2-CZ 4.24Å; P34-F36 HydrophobicContact CB-CD1 3.74Å; P34-F36 HydrophobicContact CB-CE1 3.59Å; P34-F36 HydrophobicContact CB-CE2 4.39Å; P34-F36 HydrophobicContact CB-CG 4.21Å; P34-F36 HydrophobicContact CB-CZ 3.95Å; P34-F36 WeakPolarHBondContact CG-O 3.35Å
37	L	97.5	Very high	91.9	Very high	19 Å²	19	87.3 Å²	87.3	10%	0.099	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	125.5	170.1	178.9	66.2	0	0	0	108.8	V10 I11 G12 V17 V39 I48 T51	V10-L37 PolarHBondContact O-N 2.68Å; I11-L37 HydrophobicContact CG1-CB 4.36Å; I11-L37 HydrophobicContact CG2-CB 4.4Å; I11-L37 HydrophobicContact CG2-CD2 4.26Å; G12-L37 PolarHBondContact N-O 2.99Å; V17-L37 WeakPolarHBondContact CG2-O 3.25Å; L37-V39 HydrophobicContact CD2-CG2 3.97Å; L37-V39 HydrophobicContact CG-CG2 4.09Å; L37-I48 HydrophobicContact CD2-CG1 4.29Å; L37-T51 HydrophobicContact CB-CG2 3.82Å; L37-T51 HydrophobicContact CD2-CG2 4.09Å; L37-T51 HydrophobicContact CG-CG2 4.46Å
38	V	97.9	Very high	92.1	Very high	43 Å²	43	84 Å²	84	26%	0.261	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	119.8	166.1	-177.2	0	0	0	0	107.4	G12 E14 V17 E40	G12-V38 CarbonylContact O-C 3.55Å; G12-V38 WeakPolarHBondContact O-CA 3.31Å; E14-V38 HydrophobicContact CB-CG1 4.15Å; V17-V38 HydrophobicContact CB-CG2 3.92Å; V17-V38 HydrophobicContact CG1-CG2 3.67Å; V17-V38 HydrophobicContact CG2-CG2 4.14Å; V38-E40 HydrophobicContact CG1-CG 4.28Å
39	V	97.4	Very high	92.3	Very high	13 Å²	13	80.6 Å²	80.6	8%	0.079	39%	0.39	C	S	.	.			trans	-95.8	113.2	179.1	-179.6	0	0	0	0	108.9	I11 G12 L37 T43 I48 I98	I11-V39 HydrophobicContact CG2-CG2 3.9Å; G12-V39 PolarHBondContact O-N 2.8Å; L37-V39 HydrophobicContact CD2-CG2 3.97Å; L37-V39 HydrophobicContact CG-CG2 4.09Å; V39-T43 HydrophobicContact CG1-CG2 4.15Å; V39-T43 HydrophobicContact CG2-CG2 4.48Å; V39-I48 HydrophobicContact CG1-CD1 3.93Å; V39-I48 HydrophobicContact CG1-CG1 4.4Å; V39-I48 HydrophobicContact CG2-CD1 4.46Å; V39-I48 HydrophobicContact CG2-CG1 4.16Å; V39-I98 HydrophobicContact CB-CD1 3.76Å; V39-I98 HydrophobicContact CG1-CD1 4.2Å; V39-I98 HydrophobicContact CG1-CG1 4.44Å; V39-I98 HydrophobicContact CG2-CD1 3.81Å; V39-I98 HydrophobicContact CG2-CG2 4.16Å
40	E	95.6	Very high	92.6	Very high	117 Å²	117	82.2 Å²	82.2	55%	0.547	40%	0.399	S	S	.	.			trans	-101	-178	176.3	-63.3	-172.2	-164.9	0	0	110.7	V38 D42 T43	V38-E40 HydrophobicContact CG1-CG 4.28Å; E40-D42 VanDerWaalsContact C-N 3.27Å; E40-D42 WeakPolarHBondContact CB-OD1 2.97Å; E40-D42 PolarHBondContact O-N 2.93Å; E40-T43 PolarHBondContact N-OG1 3.35Å; E40-T43 PolarHBondContact O-N 2.75Å
41	K	92.1	Very high	93	Very high	220 Å²	220	74.3 Å²	74.3	96%	0.957	37%	0.367	S	S	*	.	S	Bend	trans	-71.3	-22.7	-176.9	-68.3	-179.8	-179.6	174.5	0	113.5
42	D	95	Very high	93.4	Very high	125 Å²	125	68.6 Å²	68.6	67%	0.668	34%	0.337	S	S	*	.	S	Bend	trans	-101.8	-7.5	179.9	60.7	-17.8	0	0	0	113	E40 T44	E40-D42 VanDerWaalsContact C-N 3.27Å; E40-D42 WeakPolarHBondContact CB-OD1 2.97Å; E40-D42 PolarHBondContact O-N 2.93Å; D42-T44 PolarHBondContact O-N 3.45Å
43	T	95.1	Very high	93.5	Very high	18 Å²	18	61.8 Å²	61.8	11%	0.11	31%	0.311	C	S	.	.			trans	-58	125.8	170	-55.6	0	0	0	0	109.8	V39 E40 E47 I48	V39-T43 HydrophobicContact CG1-CG2 4.15Å; V39-T43 HydrophobicContact CG2-CG2 4.48Å; E40-T43 PolarHBondContact N-OG1 3.35Å; E40-T43 PolarHBondContact O-N 2.75Å; T43-E47 HydrophobicContact CG2-CB 4.29Å; T43-E47 HydrophobicContact CG2-CG 4.23Å; T43-I48 HydrophobicContact CG2-CD1 4.33Å; T43-I48 HydrophobicContact CG2-CG1 3.83Å
44	T	96.7	Very high	93.5	Very high	75 Å²	75	58.4 Å²	58.4	46%	0.46	30%	0.298	S	S	.	.			trans	-82.5	155.4	-175.9	70.3	0	0	0	0	111.7	D42 N46 E47 I48	D42-T44 PolarHBondContact O-N 3.45Å; T44-N46 PolarHBondContact O-N 3.22Å; T44-E47 PolarHBondContact O-N 3.48Å; T44-E47 WeakPolarHBondContact OG1-CB 3.42Å; T44-E47 PolarHBondContact OG1-N 3.37Å; T44-E47 VanDerWaalsContact OG1-N 3.14Å; T44-I48 WeakPolarHBondContact O-CG1 3.42Å; T44-I48 PolarHBondContact O-N 2.71Å
45	I	94.3	Very high	93.1	Very high	82 Å²	82	56 Å²	56	42%	0.421	28%	0.282	S	S	.	.	H	α-helix	trans	-57.7	-40.2	174	-64.1	174.2	0	0	0	110.7	E47 I48 E49 M101 V102	I45-E47 VanDerWaalsContact C-N 3.35Å; I45-E47 PolarHBondContact O-N 2.86Å; I45-I48 PolarHBondContact O-N 3.18Å; I45-E49 WeakPolarHBondContact O-CB 3.42Å; I45-E49 PolarHBondContact O-N 3.34Å; I45-M101 HydrophobicContact CG1-CE 4.08Å; I45-V102 HydrophobicContact CG2-CG1 4.01Å
46	N	92.6	Very high	92	Very high	108 Å²	108	56 Å²	56	58%	0.578	28%	0.282	S	S	*	.	H	α-helix	trans	-60.9	-44.5	178	-66.6	-1.5	0	0	0	111.1	T44 I48 E49 D50	T44-N46 PolarHBondContact O-N 3.22Å; N46-I48 VanDerWaalsContact C-N 3.32Å; N46-I48 PolarHBondContact O-N 3.27Å; N46-E49 PolarHBondContact O-N 3.09Å; N46-E49 VanDerWaalsContact O-N 3.13Å; N46-D50 WeakPolarHBondContact O-CB 3.45Å; N46-D50 PolarHBondContact O-N 3.12Å
47	E	92.9	Very high	90.2	Very high	83 Å²	83	54.7 Å²	54.7	39%	0.388	28%	0.28	S	S	.	.	H	α-helix	trans	-61.7	-39.2	178.5	-175.9	178.1	175.8	0	0	112.9	T43 T44 I45 T51	T43-E47 HydrophobicContact CG2-CB 4.29Å; T43-E47 HydrophobicContact CG2-CG 4.23Å; T44-E47 PolarHBondContact O-N 3.48Å; T44-E47 WeakPolarHBondContact OG1-CB 3.42Å; T44-E47 PolarHBondContact OG1-N 3.37Å; T44-E47 VanDerWaalsContact OG1-N 3.14Å; I45-E47 VanDerWaalsContact C-N 3.35Å; I45-E47 PolarHBondContact O-N 2.86Å; E47-T51 VanDerWaalsContact O-CB 3.28Å; E47-T51 WeakPolarHBondContact O-CB 3.33Å; E47-T51 PolarHBondContact O-N 3.35Å; E47-T51 PolarHBondContact O-OG1 2.96Å
48	I	95.3	Very high	88.1	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.8	-44.4	174.8	-59.4	164.2	0	0	0	109.9	I11 L37 V39 T43 T44 I45 N46 T51 F52 I98 M101 V102	I11-I48 HydrophobicContact CG2-CG2 4.27Å; L37-I48 HydrophobicContact CD2-CG1 4.29Å; V39-I48 HydrophobicContact CG1-CD1 3.93Å; V39-I48 HydrophobicContact CG1-CG1 4.4Å; V39-I48 HydrophobicContact CG2-CD1 4.46Å; V39-I48 HydrophobicContact CG2-CG1 4.16Å; T43-I48 HydrophobicContact CG2-CD1 4.33Å; T43-I48 HydrophobicContact CG2-CG1 3.83Å; T44-I48 WeakPolarHBondContact O-CG1 3.42Å; T44-I48 PolarHBondContact O-N 2.71Å; I45-I48 PolarHBondContact O-N 3.18Å; N46-I48 VanDerWaalsContact C-N 3.32Å; N46-I48 PolarHBondContact O-N 3.27Å; I48-T51 PolarHBondContact O-N 3.43Å; I48-F52 WeakPolarHBondContact O-CB 3.04Å; I48-F52 PolarHBondContact O-N 2.97Å; I48-I98 HydrophobicContact CD1-CG2 4.1Å; I48-I98 HydrophobicContact CG2-CG2 3.83Å; I48-M101 HydrophobicContact CD1-CE 3.81Å; I48-M101 HydrophobicContact CD1-SD 4.09Å; I48-V102 HydrophobicContact CB-CG1 3.91Å; I48-V102 HydrophobicContact CG2-CB 4.39Å; I48-V102 HydrophobicContact CG2-CG1 3.69Å; I48-V102 HydrophobicContact CG2-CG2 3.79Å
49	E	92.1	Very high	85.5	Confident	30 Å²	30	58.2 Å²	58.2	14%	0.14	31%	0.306	C	S	.	.	H	α-helix	trans	-65.5	-47.4	179.8	178.4	167	-176.4	0	0	112.3	I45 N46 T51 F52 R53 V102 H104 A105	I45-E49 WeakPolarHBondContact O-CB 3.42Å; I45-E49 PolarHBondContact O-N 3.34Å; N46-E49 PolarHBondContact O-N 3.09Å; N46-E49 VanDerWaalsContact O-N 3.13Å; E49-T51 VanDerWaalsContact C-N 3.29Å; E49-T51 PolarHBondContact O-N 3.49Å; E49-F52 PolarHBondContact O-N 3.3Å; E49-R53 VanDerWaalsContact CG-NE 3.3Å; E49-R53 WeakPolarHBondContact O-CB 3.26Å; E49-R53 VanDerWaalsContact O-CG 3.27Å; E49-R53 WeakPolarHBondContact O-CG 3.41Å; E49-R53 PolarHBondContact O-N 3.2Å; E49-R53 IonicContact OE1-CZ 3.23Å; E49-R53 VanDerWaalsContact OE1-CZ 3.23Å; E49-R53 IonicContact OE1-NE 2.93Å; E49-R53 PolarHBondContact OE1-NE 2.67Å; E49-R53 IonicContact OE1-NH2 2.68Å; E49-R53 PolarHBondContact OE1-NH2 3.05Å; E49-V102 HydrophobicContact CB-CG1 4.05Å; E49-H104 VanDerWaalsContact CD-NE2 3.28Å; E49-H104 IonicContact OE1-CD2 3.82Å; E49-H104 IonicContact OE1-NE2 3.35Å; E49-H104 PolarHBondContact OE1-NE2 3.18Å; E49-H104 IonicContact OE2-CD2 3.9Å; E49-H104 IonicContact OE2-CE1 3.48Å; E49-H104 PolarHBondContact OE2-CE1 2.95Å; E49-H104 IonicContact OE2-NE2 2.75Å; E49-H104 PolarHBondContact OE2-NE2 2.94Å; E49-A105 HydrophobicContact CG-CB 4.04Å
50	D	90.3	Very high	83	Confident	73 Å²	73	60 Å²	60	39%	0.39	33%	0.327	S	S	.	.	H	α-helix	trans	-57.8	-46.1	176.6	-65.3	-8.9	0	0	0	110	N46 R53 S54 W81	N46-D50 WeakPolarHBondContact O-CB 3.45Å; N46-D50 PolarHBondContact O-N 3.12Å; D50-R53 PolarHBondContact O-N 3.28Å; D50-S54 WeakPolarHBondContact O-CB 3.28Å; D50-S54 PolarHBondContact O-N 2.87Å; D50-W81 HydrophobicContact CB-CH2 4.37Å; D50-W81 WeakPolarHBondContact OD1-CH2 3.24Å
51	T	91.8	Very high	80.3	Confident	29 Å²	29	59.9 Å²	59.9	18%	0.178	34%	0.339	C	S	.	.	H	α-helix	trans	-65.3	-46.9	177.7	-57.3	0	0	0	0	111.6	I11 L37 E47 I48 E49 R53 S54 L55	I11-T51 HydrophobicContact CD1-CG2 4.44Å; L37-T51 HydrophobicContact CB-CG2 3.82Å; L37-T51 HydrophobicContact CD2-CG2 4.09Å; L37-T51 HydrophobicContact CG-CG2 4.46Å; E47-T51 VanDerWaalsContact O-CB 3.28Å; E47-T51 WeakPolarHBondContact O-CB 3.33Å; E47-T51 PolarHBondContact O-N 3.35Å; E47-T51 PolarHBondContact O-OG1 2.96Å; I48-T51 PolarHBondContact O-N 3.43Å; E49-T51 VanDerWaalsContact C-N 3.29Å; E49-T51 PolarHBondContact O-N 3.49Å; T51-R53 VanDerWaalsContact C-N 3.29Å; T51-R53 PolarHBondContact O-N 2.68Å; T51-S54 PolarHBondContact O-N 2.87Å; T51-S54 PolarHBondContact O-OG 3.4Å; T51-L55 HydrophobicContact CG2-CD1 3.79Å; T51-L55 HydrophobicContact CG2-CG 4.33Å; T51-L55 WeakPolarHBondContact O-CG 3.32Å; T51-L55 PolarHBondContact O-N 2.91Å
52	F	91.6	Very high	77.9	Confident	0 Å²	0	53 Å²	53	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-56.3	-44.7	177.3	174.2	-102.5	0	0	0	111.9	I11 I48 E49 L55 G56 I92 A105 L106 H109 V116	I11-F52 HydrophobicContact CD1-CB 3.98Å; I11-F52 HydrophobicContact CD1-CD2 4.33Å; I48-F52 WeakPolarHBondContact O-CB 3.04Å; I48-F52 PolarHBondContact O-N 2.97Å; E49-F52 PolarHBondContact O-N 3.3Å; F52-L55 PolarHBondContact O-N 3.13Å; F52-G56 PolarHBondContact O-N 2.84Å; F52-I92 HydrophobicContact CD2-CD1 4.35Å; F52-I92 HydrophobicContact CD2-CG2 4.5Å; F52-I92 HydrophobicContact CE2-CD1 4.17Å; F52-A105 HydrophobicContact CD1-CB 4.08Å; F52-A105 HydrophobicContact CE1-CB 4.38Å; F52-L106 HydrophobicContact CD2-CD1 4.44Å; F52-L106 HydrophobicContact CE1-CD1 4.43Å; F52-L106 HydrophobicContact CE1-CG 4.44Å; F52-L106 HydrophobicContact CE2-CD1 4.3Å; F52-L106 HydrophobicContact CE2-CG 4.09Å; F52-L106 HydrophobicContact CZ-CD1 4.3Å; F52-L106 HydrophobicContact CZ-CG 3.95Å; F52-H109 HydrophobicContact CE1-CB 4.39Å; F52-H109 HydrophobicContact CZ-CB 4.16Å; F52-V116 HydrophobicContact CE2-CG1 4.1Å; F52-V116 HydrophobicContact CE2-CG2 3.77Å; F52-V116 HydrophobicContact CZ-CG2 3.97Å
53	R	87.8	Confident	75.3	Confident	59 Å²	59	51.1 Å²	51.1	22%	0.223	32%	0.317	C	S	.	.	H	α-helix	trans	-69.5	-34.5	179.4	-71	168.4	179.8	-80.1	6.2	112.4	E49 D50 T51 G56 V58 W81	E49-R53 VanDerWaalsContact CG-NE 3.3Å; E49-R53 WeakPolarHBondContact O-CB 3.26Å; E49-R53 VanDerWaalsContact O-CG 3.27Å; E49-R53 WeakPolarHBondContact O-CG 3.41Å; E49-R53 PolarHBondContact O-N 3.2Å; E49-R53 IonicContact OE1-CZ 3.23Å; E49-R53 VanDerWaalsContact OE1-CZ 3.23Å; E49-R53 IonicContact OE1-NE 2.93Å; E49-R53 PolarHBondContact OE1-NE 2.67Å; E49-R53 IonicContact OE1-NH2 2.68Å; E49-R53 PolarHBondContact OE1-NH2 3.05Å; D50-R53 PolarHBondContact O-N 3.28Å; T51-R53 VanDerWaalsContact C-N 3.29Å; T51-R53 PolarHBondContact O-N 2.68Å; R53-G56 PolarHBondContact O-N 3.08Å; R53-V58 HydrophobicContact CG-CG2 4.34Å; R53-W81 HydrophobicContact CB-CE3 3.78Å; R53-W81 HydrophobicContact CB-CZ3 3.45Å; R53-W81 VanDerWaalsContact CB-CZ3 3.45Å; R53-W81 VanDerWaalsContact CD-CH2 3.47Å; R53-W81 HydrophobicContact CG-CE3 4.38Å; R53-W81 HydrophobicContact CG-CZ3 3.82Å
54	S	85.9	Confident	72.6	Confident	23 Å²	23	59.3 Å²	59.3	16%	0.161	35%	0.354	C	S	.	.	H	α-helix	trans	-65.2	-40.5	171.9	77	0	0	0	0	112.5	D50 T51 G56 L84 R86	D50-S54 WeakPolarHBondContact O-CB 3.28Å; D50-S54 PolarHBondContact O-N 2.87Å; T51-S54 PolarHBondContact O-N 2.87Å; T51-S54 PolarHBondContact O-OG 3.4Å; S54-G56 VanDerWaalsContact C-N 3.28Å; S54-G56 PolarHBondContact O-N 2.88Å; S54-L84 CarbonylContact C-O 3.32Å; S54-L84 WeakPolarHBondContact CA-O 3.16Å; S54-L84 CarbonylContact O-C 3.59Å; S54-R86 PolarHBondContact O-N 2.73Å; S54-R86 VanDerWaalsContact O-N 3.12Å
55	L	83.5	Confident	70	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.016	36%	0.355	C	S	.	.	H	α-helix	trans	-75.1	-25.3	177.4	-63.7	169	0	0	0	111.9	A9 I11 T51 F52 I89 I92	A9-L55 HydrophobicContact CB-CB 4.4Å; A9-L55 HydrophobicContact CB-CD1 3.93Å; A9-L55 HydrophobicContact CB-CD2 3.87Å; A9-L55 HydrophobicContact CB-CG 4.28Å; I11-L55 HydrophobicContact CD1-CD1 4.09Å; I11-L55 HydrophobicContact CG1-CD1 4.02Å; T51-L55 HydrophobicContact CG2-CD1 3.79Å; T51-L55 HydrophobicContact CG2-CG 4.33Å; T51-L55 WeakPolarHBondContact O-CG 3.32Å; T51-L55 PolarHBondContact O-N 2.91Å; F52-L55 PolarHBondContact O-N 3.13Å; L55-I89 HydrophobicContact CD2-CG1 4.45Å; L55-I92 HydrophobicContact CB-CD1 3.88Å; L55-I92 HydrophobicContact CB-CG1 4.25Å
56	G	70.9	Confident	67.5	Low	0 Å²	0	59.4 Å²	59.4	0%	0	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	174.6	176.8	0	0	0	0	0	113.8	F52 R53 S54 N85	F52-G56 PolarHBondContact O-N 2.84Å; R53-G56 PolarHBondContact O-N 3.08Å; S54-G56 VanDerWaalsContact C-N 3.28Å; S54-G56 PolarHBondContact O-N 2.88Å; G56-N85 PolarHBondContact O-OD1 2.81Å
57	S	58.8	Low	65.3	Low	29 Å²	29	60.7 Å²	60.7	20%	0.203	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	70.4	162.1	-69.6	0	0	0	0	107.6	S59 N85 H111	S57-S59 VanDerWaalsContact C-N 3.33Å; S57-S59 PolarHBondContact O-N 3.05Å; S57-S59 VanDerWaalsContact O-N 3.08Å; S57-N85 WeakPolarHBondContact CA-ND2 3.49Å; S57-N85 VanDerWaalsContact CA-OD1 3.27Å; S57-N85 WeakPolarHBondContact CA-OD1 3.01Å; S57-H111 PolarHBondContact O-CD2 3.24Å
58	V	52.9	Low	63.5	Low	51 Å²	51	60.8 Å²	60.8	31%	0.309	39%	0.385	S	S	.	.			trans	-84.5	85.7	177.2	-173.8	0	0	0	0	107.9	R53 G60 N85	R53-V58 HydrophobicContact CG-CG2 4.34Å; V58-G60 PolarHBondContact O-N 3.08Å; V58-N85 PolarHBondContact N-OD1 3.12Å
59	S	43.4	Very low	61.4	Low	85 Å²	85	68.6 Å²	68.6	59%	0.594	42%	0.421	S	S	*	.			trans	-73.6	68	159.5	29.1	0	0	0	0	109.2	S57 S61 H111	S57-S59 VanDerWaalsContact C-N 3.33Å; S57-S59 PolarHBondContact O-N 3.05Å; S57-S59 VanDerWaalsContact O-N 3.08Å; S59-S61 PolarHBondContact O-N 3.42Å; S59-H111 PolarHBondContact OG-CE1 2.8Å; S59-H111 PolarHBondContact OG-NE2 3.33Å
60	G	43.4	Very low	59.2	Low	51 Å²	51	76 Å²	76	53%	0.526	46%	0.456	S	S	.	.			trans	-82.5	107.5	166	0	0	0	0	0	108.2	V58 V62	V58-G60 PolarHBondContact O-N 3.08Å; G60-V62 PolarHBondContact O-N 3.03Å; G60-V62 VanDerWaalsContact O-N 3.1Å
61	S	39.4	Very low	57.2	Low	113 Å²	113	79 Å²	79	79%	0.79	47%	0.471	S	S	*	.			trans	-45.9	116.6	162.6	42.7	0	0	0	0	108.7	S59 A63	S59-S61 PolarHBondContact O-N 3.42Å; S61-A63 PolarHBondContact O-N 3.33Å
62	V	42.5	Very low	55.1	Low	76 Å²	76	81.4 Å²	81.4	46%	0.461	49%	0.488	S	S	.	.			trans	-50.8	115.8	163.3	-168.9	0	0	0	0	104.9	G60 E64 I78	G60-V62 PolarHBondContact O-N 3.03Å; G60-V62 VanDerWaalsContact O-N 3.1Å; V62-E64 PolarHBondContact O-N 3.28Å; V62-I78 HydrophobicContact CG1-CG2 4.37Å
63	A	40.6	Very low	53.2	Low	85 Å²	85	85.2 Å²	85.2	70%	0.702	51%	0.512	S	S	*	.			trans	-50.8	120.6	167.1	0	0	0	0	0	105.6	S61 A65	S61-A63 PolarHBondContact O-N 3.33Å; A63-A65 PolarHBondContact O-N 3.37Å
64	E	37.8	Very low	51.5	Low	191 Å²	191	88.2 Å²	88.2	89%	0.893	53%	0.532	S	S	*	.			trans	-45.9	111	177.3	-77.7	177	149.6	0	0	107.5	V62 N66	V62-E64 PolarHBondContact O-N 3.28Å; E64-N66 PolarHBondContact O-N 3.38Å
65	A	41.3	Very low	49.6	Very low	59 Å²	59	94 Å²	94	49%	0.488	55%	0.551	S	S	.	*			trans	-57.7	112.9	176.4	0	0	0	0	0	106.2	A63 P67 W75	A63-A65 PolarHBondContact O-N 3.37Å; A65-P67 WeakPolarHBondContact O-CD 3.34Å; A65-W75 HydrophobicContact CB-CH2 4.03Å
66	N	41.8	Very low	47.8	Very low	100 Å²	100	100.4 Å²	100.4	54%	0.535	58%	0.584	S	S	.	*			trans	-59.4	113.6	172.5	179.7	3.1	0	0	0	106.6	E64 S68	E64-N66 PolarHBondContact O-N 3.38Å; N66-S68 VanDerWaalsContact CG-OG 3.27Å; N66-S68 PolarHBondContact ND2-OG 3.49Å; N66-S68 PolarHBondContact O-N 3.06Å; N66-S68 PolarHBondContact OD1-OG 3.08Å
67	P	47.9	Very low	46.5	Very low	134 Å²	134	106.5 Å²	106.5	87%	0.87	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	3.8	-170.7	-18.9	31.1	0	0	0	114.5	A65	A65-P67 WeakPolarHBondContact O-CD 3.34Å
68	S	53.7	Low	45.9	Very low	86 Å²	86	107.7 Å²	107.7	60%	0.601	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	6.5	-165.2	63.1	0	0	0	0	115.5	N66	N66-S68 VanDerWaalsContact CG-OG 3.27Å; N66-S68 PolarHBondContact ND2-OG 3.49Å; N66-S68 PolarHBondContact O-N 3.06Å; N66-S68 PolarHBondContact OD1-OG 3.08Å
69	Q	51.2	Low	45.5	Very low	163 Å²	163	109.7 Å²	109.7	76%	0.762	63%	0.625	S	S	*	*	S	Bend	trans	-119.1	111.7	170.4	-77.3	-178.8	-11.7	0	0	111.1	D71	Q69-D71 PolarHBondContact O-N 3.23Å
70	H	47.4	Very low	45.4	Very low	187 Å²	187	107.9 Å²	107.9	87%	0.866	61%	0.613	S	S	*	*	S	Bend	trans	-56	91.3	175	-99.7	-90.8	0	0	0	111.2
71	D	48.1	Very low	45.2	Very low	135 Å²	135	109.6 Å²	109.6	72%	0.722	60%	0.604	S	S	*	*				176.4	117.2	116.7	-84.5	-19.5	0	0	0	106.9	Q69	Q69-D71 PolarHBondContact O-N 3.23Å
72	P	46.8	Very low	45.1	Very low	80 Å²	80	110.3 Å²	110.3	52%	0.519	60%	0.595	S	S	.	*			trans	-71.6	130	177.2	27.1	-29.6	0	0	0	109.7	W75	P72-W75 HydrophobicContact CB-CD2 4.43Å; P72-W75 VanDerWaalsContact CB-CE2 3.41Å; P72-W75 HydrophobicContact CB-CZ2 3.53Å
73	P	51.9	Low	44.9	Very low	79 Å²	79	115 Å²	115	51%	0.513	61%	0.609	S	S	.	*			trans	-57	144.5	156.9	25.6	-31	0	0	0	108.3	W75 I78	P73-W75 PolarHBondContact O-N 3.39Å; P73-I78 HydrophobicContact CB-CD1 4.27Å; P73-I78 HydrophobicContact CG-CD1 3.68Å
74	L	52.2	Low	45.3	Very low	122 Å²	122	114 Å²	114	64%	0.639	59%	0.591	S	S	*	*			trans	-46.6	112.4	-176.8	-89.9	98.6	0	0	0	110.4	D76 E77	L74-D76 PolarHBondContact O-N 3.43Å; L74-D76 VanDerWaalsContact O-N 3.07Å; L74-E77 HydrophobicContact CB-CB 4.48Å; L74-E77 WeakPolarHBondContact O-CB 3.37Å; L74-E77 PolarHBondContact O-N 2.9Å
75	W	46.6	Very low	46.5	Very low	146 Å²	146	107.7 Å²	107.7	55%	0.553	56%	0.564	S	S	*	*	H	α-helix	trans	-58.5	-23.6	-178.4	-60.2	103.8	0	0	0	113	A65 P72 P73 E77 D79	A65-W75 HydrophobicContact CB-CH2 4.03Å; P72-W75 HydrophobicContact CB-CD2 4.43Å; P72-W75 VanDerWaalsContact CB-CE2 3.41Å; P72-W75 HydrophobicContact CB-CZ2 3.53Å; P73-W75 PolarHBondContact O-N 3.39Å; W75-E77 VanDerWaalsContact C-N 3.29Å; W75-E77 PolarHBondContact O-N 3.49Å; W75-D79 PolarHBondContact O-N 3Å
76	D	45.5	Very low	47.9	Very low	136 Å²	136	105.6 Å²	105.6	73%	0.727	54%	0.543	S	S	*	.	H	α-helix	trans	-64.4	-30.4	173.2	-72.9	-30	0	0	0	113.2	L74	L74-D76 PolarHBondContact O-N 3.43Å; L74-D76 VanDerWaalsContact O-N 3.07Å
77	E	44.3	Very low	49.7	Very low	129 Å²	129	106.8 Å²	106.8	60%	0.603	55%	0.549	S	S	*	.	H	α-helix	trans	-79.4	-34.5	-177.4	-153.8	169.2	-152.9	0	0	110.9	L74 W75 S80 W81	L74-E77 HydrophobicContact CB-CB 4.48Å; L74-E77 WeakPolarHBondContact O-CB 3.37Å; L74-E77 PolarHBondContact O-N 2.9Å; W75-E77 VanDerWaalsContact C-N 3.29Å; W75-E77 PolarHBondContact O-N 3.49Å; E77-S80 PolarHBondContact O-OG 3.31Å; E77-W81 PolarHBondContact O-NE1 2.78Å
78	I	44.3	Very low	51.4	Low	54 Å²	54	102.3 Å²	102.3	28%	0.277	52%	0.518	S	S	.	.	H	α-helix	trans	-80.4	-38.6	-177.8	-65.7	174.1	0	0	0	112.4	V62 P73 S80	V62-I78 HydrophobicContact CG1-CG2 4.37Å; P73-I78 HydrophobicContact CB-CD1 4.27Å; P73-I78 HydrophobicContact CG-CD1 3.68Å; I78-S80 VanDerWaalsContact C-N 3.28Å; I78-S80 PolarHBondContact O-N 3.29Å
79	D	44.4	Very low	53.1	Low	92 Å²	92	98.2 Å²	98.2	49%	0.492	49%	0.49	S	S	.	.	H	α-helix	trans	-71.5	-23.1	176.7	-94.3	-8.3	0	0	0	112.5	W75 W81 Q82 F83	W75-D79 PolarHBondContact O-N 3Å; D79-W81 PolarHBondContact O-N 2.82Å; D79-Q82 PolarHBondContact O-N 2.6Å; D79-F83 WeakPolarHBondContact O-CD2 3.43Å
80	S	42.2	Very low	55	Low	48 Å²	48	91 Å²	91	34%	0.336	46%	0.459	S	S	.	.	H	α-helix	trans	-59.5	-33	177.4	77	0	0	0	0	113.1	E77 I78 Q82 F83 L84	E77-S80 PolarHBondContact O-OG 3.31Å; I78-S80 VanDerWaalsContact C-N 3.28Å; I78-S80 PolarHBondContact O-N 3.29Å; S80-Q82 PolarHBondContact O-N 2.91Å; S80-F83 PolarHBondContact O-N 3.44Å; S80-L84 WeakPolarHBondContact O-CD1 3.03Å; S80-L84 VanDerWaalsContact O-CG 3.25Å; S80-L84 WeakPolarHBondContact O-CG 3.19Å; S80-L84 PolarHBondContact O-N 3.2Å
81	W	38.9	Very low	57.2	Low	87 Å²	87	85.4 Å²	85.4	33%	0.33	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-70.4	-28.2	179.9	-57.2	83.5	0	0	0	113.4	D50 R53 E77 D79 F83	D50-W81 HydrophobicContact CB-CH2 4.37Å; D50-W81 WeakPolarHBondContact OD1-CH2 3.24Å; R53-W81 HydrophobicContact CB-CE3 3.78Å; R53-W81 HydrophobicContact CB-CZ3 3.45Å; R53-W81 VanDerWaalsContact CB-CZ3 3.45Å; R53-W81 VanDerWaalsContact CD-CH2 3.47Å; R53-W81 HydrophobicContact CG-CE3 4.38Å; R53-W81 HydrophobicContact CG-CZ3 3.82Å; E77-W81 PolarHBondContact O-NE1 2.78Å; D79-W81 PolarHBondContact O-N 2.82Å; W81-F83 VanDerWaalsContact C-N 3.27Å; W81-F83 PolarHBondContact O-N 2.8Å
82	Q	36.8	Very low	59.4	Low	128 Å²	128	79 Å²	79	60%	0.598	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-71.9	-22.8	178.2	-75.5	-170.5	7.3	0	0	112.8	D79 S80	D79-Q82 PolarHBondContact O-N 2.6Å; S80-Q82 PolarHBondContact O-N 2.91Å
83	F	39.9	Very low	61.8	Low	174 Å²	174	75.9 Å²	75.9	76%	0.763	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-97.3	-5.3	179.7	-71.2	-78.9	0	0	0	114.2	D79 S80 W81	D79-F83 WeakPolarHBondContact O-CD2 3.43Å; S80-F83 PolarHBondContact O-N 3.44Å; W81-F83 VanDerWaalsContact C-N 3.27Å; W81-F83 PolarHBondContact O-N 2.8Å
84	L	48.9	Very low	63.9	Low	63 Å²	63	72.1 Å²	72.1	33%	0.33	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-13.4	-174.1	-77	171.8	0	0	0	114.4	S54 S80 R86	S54-L84 CarbonylContact C-O 3.32Å; S54-L84 WeakPolarHBondContact CA-O 3.16Å; S54-L84 CarbonylContact O-C 3.59Å; S80-L84 WeakPolarHBondContact O-CD1 3.03Å; S80-L84 VanDerWaalsContact O-CG 3.25Å; S80-L84 WeakPolarHBondContact O-CG 3.19Å; S80-L84 PolarHBondContact O-N 3.2Å; L84-R86 PolarHBondContact O-N 2.84Å; L84-R86 VanDerWaalsContact O-N 3.15Å
85	N	62.7	Low	66.1	Low	59 Å²	59	66.3 Å²	66.3	32%	0.316	33%	0.325	S	S	.	.			trans	-62.1	111.8	178	-99.3	3.3	0	0	0	112.2	G56 S57 V58 D87	G56-N85 PolarHBondContact O-OD1 2.81Å; S57-N85 WeakPolarHBondContact CA-ND2 3.49Å; S57-N85 VanDerWaalsContact CA-OD1 3.27Å; S57-N85 WeakPolarHBondContact CA-OD1 3.01Å; V58-N85 PolarHBondContact N-OD1 3.12Å; N85-D87 PolarHBondContact O-N 3.31Å
86	R	71.3	Confident	68.4	Low	16 Å²	16	59.8 Å²	59.8	6%	0.06	30%	0.301	C	S	.	.			trans	-79.3	99	168.5	-78.9	-159.6	67.3	165.2	4.9	111.6	E27 S54 L84 D88 I89	E27-R86 IonicContact OE1-CZ 3.45Å; E27-R86 IonicContact OE1-NH1 3.69Å; E27-R86 IonicContact OE1-NH2 3.58Å; E27-R86 PolarHBondContact OE1-NH2 3.17Å; S54-R86 PolarHBondContact O-N 2.73Å; S54-R86 VanDerWaalsContact O-N 3.12Å; L84-R86 PolarHBondContact O-N 2.84Å; L84-R86 VanDerWaalsContact O-N 3.15Å; R86-D88 WeakPolarHBondContact CB-OD1 3.39Å; R86-D88 IonicContact CZ-OD1 2.69Å; R86-D88 VanDerWaalsContact CZ-OD1 3.24Å; R86-D88 IonicContact CZ-OD2 3.26Å; R86-D88 IonicContact NE-OD1 2.79Å; R86-D88 PolarHBondContact NE-OD1 3.18Å; R86-D88 IonicContact NE-OD2 3.56Å; R86-D88 IonicContact NH2-OD1 3.43Å; R86-D88 PolarHBondContact NH2-OD1 3.33Å; R86-D88 IonicContact NH2-OD2 2.65Å; R86-D88 PolarHBondContact NH2-OD2 2.9Å; R86-D88 PolarHBondContact O-N 2.77Å; R86-D88 VanDerWaalsContact O-N 3.09Å; R86-I89 HydrophobicContact CB-CB 4.43Å; R86-I89 HydrophobicContact CB-CG1 3.59Å; R86-I89 HydrophobicContact CG-CG1 4.34Å; R86-I89 PolarHBondContact O-N 2.93Å
87	D	78	Confident	70.9	Confident	124 Å²	124	56.5 Å²	56.5	66%	0.663	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-4.5	174.7	78.2	-27.6	0	0	0	113.9	K6 N85	K6-D87 PolarHBondContact NZ-O 2.92Å; N85-D87 PolarHBondContact O-N 3.31Å
88	D	85	Confident	73.4	Confident	40 Å²	40	50.4 Å²	50.4	21%	0.214	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	0.3	179.3	56.6	-0.9	0	0	0	113.7	K6 L7 R86	K6-D88 CarbonylContact C-O 3.52Å; K6-D88 WeakPolarHBondContact CA-O 3.13Å; L7-D88 PolarHBondContact N-O 2.88Å; R86-D88 WeakPolarHBondContact CB-OD1 3.39Å; R86-D88 IonicContact CZ-OD1 2.69Å; R86-D88 VanDerWaalsContact CZ-OD1 3.24Å; R86-D88 IonicContact CZ-OD2 3.26Å; R86-D88 IonicContact NE-OD1 2.79Å; R86-D88 PolarHBondContact NE-OD1 3.18Å; R86-D88 IonicContact NE-OD2 3.56Å; R86-D88 IonicContact NH2-OD1 3.43Å; R86-D88 PolarHBondContact NH2-OD1 3.33Å; R86-D88 IonicContact NH2-OD2 2.65Å; R86-D88 PolarHBondContact NH2-OD2 2.9Å; R86-D88 PolarHBondContact O-N 2.77Å; R86-D88 VanDerWaalsContact O-N 3.09Å
89	I	89.3	Confident	75.7	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	130.9	167.8	-57.9	-54.6	0	0	0	110.2	L7 A9 N35 L55 R86 I91 I92 P114	L7-I89 HydrophobicContact CB-CD1 3.87Å; A9-I89 HydrophobicContact CB-CD1 4.04Å; A9-I89 HydrophobicContact CB-CG1 4.34Å; A9-I89 HydrophobicContact CB-CG2 3.89Å; N35-I89 HydrophobicContact CB-CD1 4.09Å; L55-I89 HydrophobicContact CD2-CG1 4.45Å; R86-I89 HydrophobicContact CB-CB 4.43Å; R86-I89 HydrophobicContact CB-CG1 3.59Å; R86-I89 HydrophobicContact CG-CG1 4.34Å; R86-I89 PolarHBondContact O-N 2.93Å; I89-I91 WeakPolarHBondContact CG2-O 3.3Å; I89-I92 HydrophobicContact CG2-CG1 3.92Å; I89-P114 HydrophobicContact CG2-CB 3.92Å
90	G	90.3	Very high	78.1	Confident	12 Å²	12	47.2 Å²	47.2	12%	0.124	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-32.6	175.7	0	0	0	0	0	113.2	L7 P114 A115	L7-G90 PolarHBondContact O-N 3.46Å; G90-P114 CarbonylContact O-C 3.45Å; G90-P114 WeakPolarHBondContact O-CA 3.17Å; G90-A115 PolarHBondContact O-N 2.96Å
91	I	93.1	Very high	80.6	Confident	69 Å²	69	48.6 Å²	48.6	35%	0.354	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	135.8	-177	-55.9	176.5	0	0	0	108.7	L7 I8 A9 I89 L93 A115	L7-I91 PolarHBondContact O-N 2.94Å; I8-I91 CarbonylContact C-O 3.44Å; I8-I91 WeakPolarHBondContact CA-O 3.32Å; I8-I91 HydrophobicContact CG1-CB 4.37Å; I8-I91 HydrophobicContact CG2-CB 4.44Å; A9-I91 PolarHBondContact N-O 2.95Å; I89-I91 WeakPolarHBondContact CG2-O 3.3Å; I91-L93 HydrophobicContact CG2-CD2 3.79Å; I91-L93 HydrophobicContact CG2-CG 4.36Å; I91-A115 CarbonylContact C-O 3.57Å; I91-A115 VanDerWaalsContact CA-O 3.25Å; I91-A115 WeakPolarHBondContact CA-O 3.11Å; I91-A115 HydrophobicContact CG1-CB 4.47Å
92	I	94.8	Very high	83.2	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	118.2	167.5	-60.6	169.4	0	0	0	107.1	A9 I11 F52 L55 I89 P114 A115 V116 L117	A9-I92 HydrophobicContact CB-CG1 4.24Å; I11-I92 HydrophobicContact CD1-CG2 4.43Å; F52-I92 HydrophobicContact CD2-CD1 4.35Å; F52-I92 HydrophobicContact CD2-CG2 4.5Å; F52-I92 HydrophobicContact CE2-CD1 4.17Å; L55-I92 HydrophobicContact CB-CD1 3.88Å; L55-I92 HydrophobicContact CB-CG1 4.25Å; I89-I92 HydrophobicContact CG2-CG1 3.92Å; I92-P114 HydrophobicContact CD1-CB 4.13Å; I92-P114 HydrophobicContact CD1-CG 3.62Å; I92-P114 HydrophobicContact CG1-CB 4.04Å; I92-P114 HydrophobicContact CG1-CG 4.1Å; I92-A115 PolarHBondContact N-O 3.19Å; I92-V116 HydrophobicContact CB-CG2 4.47Å; I92-V116 HydrophobicContact CD1-CG2 4.46Å; I92-V116 CarbonylContact O-C 3.52Å; I92-V116 WeakPolarHBondContact O-CA 3.37Å; I92-L117 PolarHBondContact O-N 3.24Å
93	L	96.8	Very high	85.7	Confident	15 Å²	15	39.9 Å²	39.9	8%	0.079	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	129.9	168.8	-55.5	-178.4	0	0	0	108.2	I8 A9 V10 I11 F20 I91 L117 I119	I8-L93 HydrophobicContact CG2-CD1 3.82Å; I8-L93 HydrophobicContact CG2-CG 3.81Å; A9-L93 PolarHBondContact O-N 3.22Å; V10-L93 CarbonylContact C-O 3.53Å; V10-L93 WeakPolarHBondContact CA-O 3.33Å; V10-L93 HydrophobicContact CG2-CB 4.44Å; V10-L93 HydrophobicContact CG2-CD1 4.45Å; I11-L93 PolarHBondContact N-O 3.43Å; F20-L93 HydrophobicContact CD1-CD1 4.02Å; F20-L93 HydrophobicContact CD2-CD1 4.49Å; F20-L93 HydrophobicContact CE1-CD1 3.36Å; F20-L93 HydrophobicContact CE2-CD1 3.94Å; F20-L93 HydrophobicContact CZ-CD1 3.32Å; I91-L93 HydrophobicContact CG2-CD2 3.79Å; I91-L93 HydrophobicContact CG2-CG 4.36Å; L93-L117 WeakPolarHBondContact CA-O 3.09Å; L93-L117 HydrophobicContact CD2-CB 3.89Å; L93-L117 HydrophobicContact CD2-CD2 3.85Å; L93-L117 HydrophobicContact CD2-CG 4.28Å; L93-I119 HydrophobicContact CB-CD1 4.29Å
94	I	97.2	Very high	88.1	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	134.6	177.1	-175.5	166.3	0	0	0	110.4	I11 Q96 I98 A99 V102 L106 V116 L117 E118 I119	I11-I94 HydrophobicContact CB-CB 4.35Å; I11-I94 HydrophobicContact CB-CD1 4.25Å; I11-I94 HydrophobicContact CB-CG1 4.04Å; I11-I94 HydrophobicContact CD1-CD1 4.43Å; I11-I94 HydrophobicContact CG2-CD1 4.15Å; I11-I94 HydrophobicContact CG2-CG1 4.18Å; I11-I94 VanDerWaalsContact O-CA 3.24Å; I11-I94 WeakPolarHBondContact O-CA 3.41Å; I94-Q96 PolarHBondContact O-N 3.34Å; I94-I98 HydrophobicContact CD1-CG2 4.19Å; I94-I98 HydrophobicContact CG1-CB 4.27Å; I94-I98 HydrophobicContact CG1-CG2 4.33Å; I94-A99 HydrophobicContact CD1-CB 4.01Å; I94-A99 HydrophobicContact CG1-CB 4.13Å; I94-A99 HydrophobicContact CG2-CB 4.05Å; I94-V102 HydrophobicContact CD1-CG2 4.36Å; I94-L106 HydrophobicContact CG2-CD2 4.43Å; I94-V116 HydrophobicContact CG2-CG1 4.03Å; I94-L117 PolarHBondContact N-O 3.12Å; I94-E118 HydrophobicContact CG2-CG 4.21Å; I94-E118 CarbonylContact O-C 3.45Å; I94-E118 VanDerWaalsContact O-CA 3.31Å; I94-E118 WeakPolarHBondContact O-CA 3.44Å; I94-I119 WeakPolarHBondContact O-CG1 3.41Å; I94-I119 PolarHBondContact O-N 3.17Å
95	N	97.8	Very high	89.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	133.7	172.1	-67.2	128.5	0	0	0	109.6	I11 G12 D13 T16 Y97 I98 A99 I119 P120 S121	I11-N95 PolarHBondContact O-N 3.07Å; I11-N95 VanDerWaalsContact O-N 3.12Å; G12-N95 WeakPolarHBondContact CA-OD1 3.25Å; D13-N95 PolarHBondContact N-OD1 2.91Å; T16-N95 WeakPolarHBondContact CG2-ND2 3.47Å; T16-N95 PolarHBondContact OG1-ND2 2.72Å; T16-N95 PolarHBondContact OG1-OD1 2.98Å; N95-Y97 VanDerWaalsContact C-N 3.26Å; N95-Y97 HydrophobicContact CB-CD1 3.74Å; N95-Y97 HydrophobicContact CB-CE1 3.62Å; N95-Y97 PolarHBondContact O-N 2.92Å; N95-I98 HydrophobicContact CB-CD1 3.89Å; N95-I98 HydrophobicContact CB-CG1 4.08Å; N95-I98 WeakPolarHBondContact O-CB 3.25Å; N95-I98 PolarHBondContact O-N 2.88Å; N95-A99 PolarHBondContact O-N 2.86Å; N95-I119 CarbonylContact C-O 3.59Å; N95-I119 VanDerWaalsContact CA-O 3.28Å; N95-I119 WeakPolarHBondContact CA-O 3.34Å; N95-P120 PolarHBondContact ND2-O 3.49Å; N95-S121 WeakPolarHBondContact ND2-CB 3.27Å
96	Q	96.1	Very high	91.1	Very high	10 Å²	10	31.1 Å²	31.1	5%	0.047	15%	0.153	C	C	.	.	H	α-helix	trans	-56.7	-40	-175.5	-179.4	176.5	71.1	0	0	112.5	I94 I98 A99 E100 E118 I119 D127	I94-Q96 PolarHBondContact O-N 3.34Å; Q96-I98 PolarHBondContact O-N 3.01Å; Q96-A99 WeakPolarHBondContact O-CB 3.44Å; Q96-A99 PolarHBondContact O-N 3.36Å; Q96-E100 WeakPolarHBondContact O-CG 3.39Å; Q96-E100 PolarHBondContact O-N 2.84Å; Q96-E118 HydrophobicContact CB-CB 4.24Å; Q96-E118 WeakPolarHBondContact CG-OE2 3.01Å; Q96-I119 PolarHBondContact N-O 3.35Å; Q96-D127 PolarHBondContact NE2-O 2.9Å; Q96-D127 PolarHBondContact OE1-O 3.41Å
97	Y	96.1	Very high	91.7	Very high	67 Å²	67	32.6 Å²	32.6	26%	0.263	16%	0.162	S	C	.	.	H	α-helix	trans	-65.9	-28.6	179.9	84.4	-90.9	0	0	0	112.6	D13 N95 H124	D13-Y97 WeakPolarHBondContact CB-OH 3.33Å; N95-Y97 VanDerWaalsContact C-N 3.26Å; N95-Y97 HydrophobicContact CB-CD1 3.74Å; N95-Y97 HydrophobicContact CB-CE1 3.62Å; N95-Y97 PolarHBondContact O-N 2.92Å; Y97-H124 HydrophobicContact CD1-CB 3.84Å; Y97-H124 AromaticContact CD1-CG 3.78Å; Y97-H124 AromaticContact CD1-ND1 3.69Å; Y97-H124 AromaticContact CE1-ND1 3.88Å; Y97-H124 HydrophobicContact CG-CB 4.21Å; Y97-H124 AromaticContact CG-CG 3.91Å
98	I	96.8	Very high	92.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-77	-41.6	173.3	-58.3	173.6	0	0	0	109.7	I11 V39 I48 I94 N95 Q96 E100 M101	I11-I98 HydrophobicContact CG2-CG2 4.11Å; V39-I98 HydrophobicContact CB-CD1 3.76Å; V39-I98 HydrophobicContact CG1-CD1 4.2Å; V39-I98 HydrophobicContact CG1-CG1 4.44Å; V39-I98 HydrophobicContact CG2-CD1 3.81Å; V39-I98 HydrophobicContact CG2-CG2 4.16Å; I48-I98 HydrophobicContact CD1-CG2 4.1Å; I48-I98 HydrophobicContact CG2-CG2 3.83Å; I94-I98 HydrophobicContact CD1-CG2 4.19Å; I94-I98 HydrophobicContact CG1-CB 4.27Å; I94-I98 HydrophobicContact CG1-CG2 4.33Å; N95-I98 HydrophobicContact CB-CD1 3.89Å; N95-I98 HydrophobicContact CB-CG1 4.08Å; N95-I98 WeakPolarHBondContact O-CB 3.25Å; N95-I98 PolarHBondContact O-N 2.88Å; Q96-I98 PolarHBondContact O-N 3.01Å; I98-E100 PolarHBondContact O-N 3.27Å; I98-M101 VanDerWaalsContact O-CB 3.28Å; I98-M101 WeakPolarHBondContact O-CB 3.49Å; I98-M101 PolarHBondContact O-N 2.65Å
99	A	94.6	Very high	92	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-56.5	-33.3	176.7	0	0	0	0	0	112.5	I94 N95 Q96 M101 V102 R103 L106 E118	I94-A99 HydrophobicContact CD1-CB 4.01Å; I94-A99 HydrophobicContact CG1-CB 4.13Å; I94-A99 HydrophobicContact CG2-CB 4.05Å; N95-A99 PolarHBondContact O-N 2.86Å; Q96-A99 WeakPolarHBondContact O-CB 3.44Å; Q96-A99 PolarHBondContact O-N 3.36Å; A99-M101 VanDerWaalsContact C-N 3.28Å; A99-M101 PolarHBondContact O-N 3.07Å; A99-V102 CarbonylContact O-C 3.55Å; A99-V102 PolarHBondContact O-N 2.69Å; A99-R103 WeakPolarHBondContact O-CA 3.38Å; A99-R103 PolarHBondContact O-N 2.79Å; A99-L106 HydrophobicContact CB-CD2 3.76Å; A99-E118 HydrophobicContact CB-CG 4.07Å
100	E	94	Very high	91.4	Very high	79 Å²	79	35 Å²	35	37%	0.369	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-60.8	-33.3	173.2	-71.8	-65.3	104.6	0	0	113.3	Q96 I98 V102 R103 K130	Q96-E100 WeakPolarHBondContact O-CG 3.39Å; Q96-E100 PolarHBondContact O-N 2.84Å; I98-E100 PolarHBondContact O-N 3.27Å; E100-V102 VanDerWaalsContact C-N 3.28Å; E100-V102 PolarHBondContact O-N 3.42Å; E100-R103 IonicContact OE1-CZ 3.05Å; E100-R103 VanDerWaalsContact OE1-CZ 3.26Å; E100-R103 IonicContact OE1-NE 3.96Å; E100-R103 PolarHBondContact OE1-NE 3.43Å; E100-R103 IonicContact OE1-NH2 3.75Å; E100-R103 PolarHBondContact OE1-NH2 3.38Å; E100-K130 HydrophobicContact CG-CD 4.35Å
101	M	94.8	Very high	90.9	Very high	77 Å²	77	38.6 Å²	38.6	38%	0.379	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-69.5	-28.6	-179.6	-57.1	169.5	68.1	0	0	112.3	I45 I48 I98 A99	I45-M101 HydrophobicContact CG1-CE 4.08Å; I48-M101 HydrophobicContact CD1-CE 3.81Å; I48-M101 HydrophobicContact CD1-SD 4.09Å; I98-M101 VanDerWaalsContact O-CB 3.28Å; I98-M101 WeakPolarHBondContact O-CB 3.49Å; I98-M101 PolarHBondContact O-N 2.65Å; A99-M101 VanDerWaalsContact C-N 3.28Å; A99-M101 PolarHBondContact O-N 3.07Å
102	V	92.8	Very high	90.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-121.3	26.4	-176	-69.4	0	0	0	0	112.1	I45 I48 E49 I94 A99 E100 H104 A105 L106	I45-V102 HydrophobicContact CG2-CG1 4.01Å; I48-V102 HydrophobicContact CB-CG1 3.91Å; I48-V102 HydrophobicContact CG2-CB 4.39Å; I48-V102 HydrophobicContact CG2-CG1 3.69Å; I48-V102 HydrophobicContact CG2-CG2 3.79Å; E49-V102 HydrophobicContact CB-CG1 4.05Å; I94-V102 HydrophobicContact CD1-CG2 4.36Å; A99-V102 CarbonylContact O-C 3.55Å; A99-V102 PolarHBondContact O-N 2.69Å; E100-V102 VanDerWaalsContact C-N 3.28Å; E100-V102 PolarHBondContact O-N 3.42Å; V102-H104 PolarHBondContact O-N 2.83Å; V102-H104 VanDerWaalsContact O-N 3.08Å; V102-A105 HydrophobicContact CB-CB 4.49Å; V102-A105 WeakPolarHBondContact O-CB 3.49Å; V102-A105 PolarHBondContact O-N 3.33Å; V102-L106 HydrophobicContact CB-CD1 4.28Å; V102-L106 HydrophobicContact CG2-CD1 3.56Å; V102-L106 VanDerWaalsContact O-CD1 3.26Å; V102-L106 WeakPolarHBondContact O-CD1 3.36Å; V102-L106 PolarHBondContact O-N 2.95Å
103	R	90.8	Very high	89.7	Confident	32 Å²	32	45.2 Å²	45.2	12%	0.121	24%	0.236	C	C	.	.	H	α-helix	trans	-55	-34.5	-172.5	-177.2	58.5	65.9	-168.5	5.6	112.8	A99 E100 A105 L106 D107 E118 K130	A99-R103 WeakPolarHBondContact O-CA 3.38Å; A99-R103 PolarHBondContact O-N 2.79Å; E100-R103 IonicContact OE1-CZ 3.05Å; E100-R103 VanDerWaalsContact OE1-CZ 3.26Å; E100-R103 IonicContact OE1-NE 3.96Å; E100-R103 PolarHBondContact OE1-NE 3.43Å; E100-R103 IonicContact OE1-NH2 3.75Å; E100-R103 PolarHBondContact OE1-NH2 3.38Å; R103-A105 VanDerWaalsContact C-N 3.35Å; R103-A105 PolarHBondContact O-N 3.42Å; R103-L106 PolarHBondContact O-N 2.86Å; R103-D107 WeakPolarHBondContact O-CB 3.28Å; R103-D107 PolarHBondContact O-N 3.34Å; R103-E118 IonicContact CZ-OE1 2.67Å; R103-E118 IonicContact CZ-OE2 3.24Å; R103-E118 VanDerWaalsContact NH1-CD 3.35Å; R103-E118 IonicContact NH1-OE1 2.91Å; R103-E118 PolarHBondContact NH1-OE1 3.04Å; R103-E118 IonicContact NH1-OE2 3.81Å; R103-E118 IonicContact NH2-OE1 3.27Å; R103-E118 PolarHBondContact NH2-OE1 2.91Å; R103-E118 IonicContact NH2-OE2 3.41Å; R103-E118 PolarHBondContact NH2-OE2 2.87Å; R103-K130 PolarHBondContact NH2-O 2.77Å
104	H	88.8	Confident	89.4	Confident	102 Å²	102	44.5 Å²	44.5	47%	0.472	23%	0.233	S	C	.	.	H	α-helix	trans	-62.3	-39.5	175.9	60.7	-74.2	0	0	0	112.6	E49 V102 D107 A108	E49-H104 VanDerWaalsContact CD-NE2 3.28Å; E49-H104 IonicContact OE1-CD2 3.82Å; E49-H104 IonicContact OE1-NE2 3.35Å; E49-H104 PolarHBondContact OE1-NE2 3.18Å; E49-H104 IonicContact OE2-CD2 3.9Å; E49-H104 IonicContact OE2-CE1 3.48Å; E49-H104 PolarHBondContact OE2-CE1 2.95Å; E49-H104 IonicContact OE2-NE2 2.75Å; E49-H104 PolarHBondContact OE2-NE2 2.94Å; V102-H104 PolarHBondContact O-N 2.83Å; V102-H104 VanDerWaalsContact O-N 3.08Å; H104-D107 PolarHBondContact O-N 3.06Å; H104-A108 WeakPolarHBondContact O-CB 3.27Å; H104-A108 PolarHBondContact O-N 3.2Å
105	A	87.3	Confident	89	Confident	3 Å²	3	46.7 Å²	46.7	3%	0.025	25%	0.251	C	S	.	.	H	α-helix	trans	-69.8	-40.8	177.9	0	0	0	0	0	111.2	E49 F52 V102 R103 A108 H109	E49-A105 HydrophobicContact CG-CB 4.04Å; F52-A105 HydrophobicContact CD1-CB 4.08Å; F52-A105 HydrophobicContact CE1-CB 4.38Å; V102-A105 HydrophobicContact CB-CB 4.49Å; V102-A105 WeakPolarHBondContact O-CB 3.49Å; V102-A105 PolarHBondContact O-N 3.33Å; R103-A105 VanDerWaalsContact C-N 3.35Å; R103-A105 PolarHBondContact O-N 3.42Å; A105-A108 PolarHBondContact O-N 2.83Å; A105-H109 PolarHBondContact O-N 3.23Å
106	L	87.3	Confident	88.7	Confident	7 Å²	7	47.6 Å²	47.6	4%	0.037	26%	0.256	C	S	.	.	H	α-helix	trans	-64.8	-42.3	174.1	-80.3	76.8	0	0	0	111.6	F52 I94 A99 V102 R103 A108 H109 V116	F52-L106 HydrophobicContact CD2-CD1 4.44Å; F52-L106 HydrophobicContact CE1-CD1 4.43Å; F52-L106 HydrophobicContact CE1-CG 4.44Å; F52-L106 HydrophobicContact CE2-CD1 4.3Å; F52-L106 HydrophobicContact CE2-CG 4.09Å; F52-L106 HydrophobicContact CZ-CD1 4.3Å; F52-L106 HydrophobicContact CZ-CG 3.95Å; I94-L106 HydrophobicContact CG2-CD2 4.43Å; A99-L106 HydrophobicContact CB-CD2 3.76Å; V102-L106 HydrophobicContact CB-CD1 4.28Å; V102-L106 HydrophobicContact CG2-CD1 3.56Å; V102-L106 VanDerWaalsContact O-CD1 3.26Å; V102-L106 WeakPolarHBondContact O-CD1 3.36Å; V102-L106 PolarHBondContact O-N 2.95Å; R103-L106 PolarHBondContact O-N 2.86Å; L106-A108 VanDerWaalsContact C-N 3.26Å; L106-A108 PolarHBondContact O-N 2.75Å; L106-H109 WeakPolarHBondContact O-CB 3.48Å; L106-H109 PolarHBondContact O-N 3.01Å; L106-V116 HydrophobicContact CD2-CG1 4.07Å; L106-V116 HydrophobicContact CG-CG1 4.45Å
107	D	84.8	Confident	88.6	Confident	48 Å²	48	51.3 Å²	51.3	26%	0.257	28%	0.276	S	S	.	.	H	α-helix	trans	-66.7	-30.3	179.6	-89.6	-18.4	0	0	0	112	R103 H104 H109 Q110 S132 R135 R136	R103-D107 WeakPolarHBondContact O-CB 3.28Å; R103-D107 PolarHBondContact O-N 3.34Å; H104-D107 PolarHBondContact O-N 3.06Å; D107-H109 VanDerWaalsContact C-N 3.26Å; D107-H109 PolarHBondContact O-N 3.02Å; D107-Q110 PolarHBondContact O-NE2 2.86Å; D107-S132 WeakPolarHBondContact OD1-CB 3.44Å; D107-R135 IonicContact OD1-NH1 2.85Å; D107-R135 IonicContact OD2-NH1 3.04Å; D107-R135 PolarHBondContact OD2-NH1 2.97Å; D107-R136 VanDerWaalsContact CA-NH2 3.32Å; D107-R136 PolarHBondContact O-NH2 3.16Å; D107-R136 IonicContact OD1-NH2 2.68Å; D107-R136 PolarHBondContact OD1-NH2 3.12Å
108	A	85.3	Confident	88.5	Confident	66 Å²	66	48.4 Å²	48.4	55%	0.545	27%	0.265	S	S	.	.	H	α-helix	trans	-70.4	-18.4	171.9	0	0	0	0	0	113.7	H104 A105 L106 Q110	H104-A108 WeakPolarHBondContact O-CB 3.27Å; H104-A108 PolarHBondContact O-N 3.2Å; A105-A108 PolarHBondContact O-N 2.83Å; L106-A108 VanDerWaalsContact C-N 3.26Å; L106-A108 PolarHBondContact O-N 2.75Å; A108-Q110 PolarHBondContact O-N 3.39Å
109	H	83.3	Confident	88.5	Confident	15 Å²	15	49.8 Å²	49.8	7%	0.069	27%	0.272	C	S	.	.			trans	-75.6	110.7	175.5	-174.4	59.6	0	0	0	110.9	F52 A105 L106 D107 H111 P114 R136	F52-H109 HydrophobicContact CE1-CB 4.39Å; F52-H109 HydrophobicContact CZ-CB 4.16Å; A105-H109 PolarHBondContact O-N 3.23Å; L106-H109 WeakPolarHBondContact O-CB 3.48Å; L106-H109 PolarHBondContact O-N 3.01Å; D107-H109 VanDerWaalsContact C-N 3.26Å; D107-H109 PolarHBondContact O-N 3.02Å; H109-H111 PolarHBondContact NE2-O 3.16Å; H109-H111 VanDerWaalsContact NE2-O 3.07Å; H109-P114 PolarHBondContact NE2-O 2.6Å; H109-R136 PolarHBondContact O-NH1 3.38Å
110	Q	77.7	Confident	88.6	Confident	134 Å²	134	53 Å²	53	63%	0.626	29%	0.293	S	S	*	.			trans	-112.5	-7.8	-177.6	-62.9	-63.2	-45.6	0	0	113.1	D107 A108	D107-Q110 PolarHBondContact O-NE2 2.86Å; A108-Q110 PolarHBondContact O-N 3.39Å
111	H	78.8	Confident	88.7	Confident	87 Å²	87	49.9 Å²	49.9	40%	0.403	28%	0.28	S	S	.	.			trans	-79.4	141.1	179.9	-62.7	-73.8	0	0	0	110.9	S57 S59 H109 I113	S57-H111 PolarHBondContact O-CD2 3.24Å; S59-H111 PolarHBondContact OG-CE1 2.8Å; S59-H111 PolarHBondContact OG-NE2 3.33Å; H109-H111 PolarHBondContact NE2-O 3.16Å; H109-H111 VanDerWaalsContact NE2-O 3.07Å; H111-I113 PolarHBondContact O-N 3.42Å
112	S	78.7	Confident	88.7	Confident	112 Å²	112	53.2 Å²	53.2	78%	0.783	29%	0.292	S	S	*	.	S	Bend	trans	-69.4	-22.3	177.5	-50	0	0	0	0	113.4
113	I	84.4	Confident	88.8	Confident	95 Å²	95	59.6 Å²	59.6	49%	0.487	32%	0.322	S	S	.	.	S	Bend	trans	-129.6	132	177.2	-59.9	-179.6	0	0	0	108	H111	H111-I113 PolarHBondContact O-N 3.42Å
114	P	89.5	Confident	89	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.336	C	S	.	.	S	Bend	cis	-67.7	144.6	-4.8	28.6	-34.8	0	0	0	112.3	I89 G90 I92 H109	I89-P114 HydrophobicContact CG2-CB 3.92Å; G90-P114 CarbonylContact O-C 3.45Å; G90-P114 WeakPolarHBondContact O-CA 3.17Å; I92-P114 HydrophobicContact CD1-CB 4.13Å; I92-P114 HydrophobicContact CD1-CG 3.62Å; I92-P114 HydrophobicContact CG1-CB 4.04Å; I92-P114 HydrophobicContact CG1-CG 4.1Å; H109-P114 PolarHBondContact NE2-O 2.6Å
115	A	89.9	Confident	89.3	Confident	46 Å²	46	62.9 Å²	62.9	38%	0.38	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	130.4	170.4	0	0	0	0	0	108.6	G90 I91 I92	G90-A115 PolarHBondContact O-N 2.96Å; I91-A115 CarbonylContact C-O 3.57Å; I91-A115 VanDerWaalsContact CA-O 3.25Å; I91-A115 WeakPolarHBondContact CA-O 3.11Å; I91-A115 HydrophobicContact CG1-CB 4.47Å; I92-A115 PolarHBondContact N-O 3.19Å
116	V	91.6	Very high	89.5	Confident	20 Å²	20	67 Å²	67	12%	0.121	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	124.9	177.4	-177.5	0	0	0	0	107.9	F52 I92 I94 L106 I133	F52-V116 HydrophobicContact CE2-CG1 4.1Å; F52-V116 HydrophobicContact CE2-CG2 3.77Å; F52-V116 HydrophobicContact CZ-CG2 3.97Å; I92-V116 HydrophobicContact CB-CG2 4.47Å; I92-V116 HydrophobicContact CD1-CG2 4.46Å; I92-V116 CarbonylContact O-C 3.52Å; I92-V116 WeakPolarHBondContact O-CA 3.37Å; I94-V116 HydrophobicContact CG2-CG1 4.03Å; L106-V116 HydrophobicContact CD2-CG1 4.07Å; L106-V116 HydrophobicContact CG-CG1 4.45Å; V116-I133 WeakPolarHBondContact O-CD1 3.47Å
117	L	93	Very high	89.6	Confident	87 Å²	87	69.9 Å²	69.9	46%	0.455	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	119.6	179.7	-178.2	63.6	0	0	0	110	I92 L93 I94 I119	I92-L117 PolarHBondContact O-N 3.24Å; L93-L117 WeakPolarHBondContact CA-O 3.09Å; L93-L117 HydrophobicContact CD2-CB 3.89Å; L93-L117 HydrophobicContact CD2-CD2 3.85Å; L93-L117 HydrophobicContact CD2-CG 4.28Å; I94-L117 PolarHBondContact N-O 3.12Å; L117-I119 HydrophobicContact CD2-CG2 4.3Å; L117-I119 HydrophobicContact CG-CG2 4.15Å
118	E	94.5	Very high	89.6	Confident	7 Å²	7	70 Å²	70	3%	0.033	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	124.7	173.6	-64.4	173.1	-137.2	0	0	109.6	I94 Q96 A99 R103 Y126 S132	I94-E118 HydrophobicContact CG2-CG 4.21Å; I94-E118 CarbonylContact O-C 3.45Å; I94-E118 VanDerWaalsContact O-CA 3.31Å; I94-E118 WeakPolarHBondContact O-CA 3.44Å; Q96-E118 HydrophobicContact CB-CB 4.24Å; Q96-E118 WeakPolarHBondContact CG-OE2 3.01Å; A99-E118 HydrophobicContact CB-CG 4.07Å; R103-E118 IonicContact CZ-OE1 2.67Å; R103-E118 IonicContact CZ-OE2 3.24Å; R103-E118 VanDerWaalsContact NH1-CD 3.35Å; R103-E118 IonicContact NH1-OE1 2.91Å; R103-E118 PolarHBondContact NH1-OE1 3.04Å; R103-E118 IonicContact NH1-OE2 3.81Å; R103-E118 IonicContact NH2-OE1 3.27Å; R103-E118 PolarHBondContact NH2-OE1 2.91Å; R103-E118 IonicContact NH2-OE2 3.41Å; R103-E118 PolarHBondContact NH2-OE2 2.87Å; E118-Y126 HydrophobicContact CB-CE2 4.35Å; E118-S132 PolarHBondContact OE1-OG 3.28Å
119	I	96.4	Very high	89.4	Confident	28 Å²	28	69.8 Å²	69.8	14%	0.144	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	152.2	-179.3	58.5	168.7	0	0	0	111.1	T16 F20 L93 I94 N95 Q96 L117	T16-I119 HydrophobicContact CG2-CD1 3.75Å; F20-I119 HydrophobicContact CE2-CD1 3.53Å; F20-I119 HydrophobicContact CZ-CD1 3.94Å; L93-I119 HydrophobicContact CB-CD1 4.29Å; I94-I119 WeakPolarHBondContact O-CG1 3.41Å; I94-I119 PolarHBondContact O-N 3.17Å; N95-I119 CarbonylContact C-O 3.59Å; N95-I119 VanDerWaalsContact CA-O 3.28Å; N95-I119 WeakPolarHBondContact CA-O 3.34Å; Q96-I119 PolarHBondContact N-O 3.35Å; L117-I119 HydrophobicContact CD2-CG2 4.3Å; L117-I119 HydrophobicContact CG-CG2 4.15Å
120	P	96.9	Very high	89.2	Confident	69 Å²	69	73.6 Å²	73.6	45%	0.448	40%	0.402	S	S	.	.			trans	-62.6	164.3	169.3	28.2	-34.7	0	0	0	110.9	N95	N95-P120 PolarHBondContact ND2-O 3.49Å
121	S	96.5	Very high	89	Confident	13 Å²	13	67.7 Å²	67.7	9%	0.091	37%	0.374	C	S	.	.			trans	-115.6	171.1	163.7	112.3	0	0	0	0	109.4	D13 N95 E123 H124	D13-S121 WeakPolarHBondContact OD2-CB 3.27Å; D13-S121 PolarHBondContact OD2-OG 3.07Å; N95-S121 WeakPolarHBondContact ND2-CB 3.27Å; S121-E123 PolarHBondContact O-N 2.85Å; S121-H124 PolarHBondContact N-O 2.74Å; S121-H124 CarbonylContact O-C 3.52Å; S121-H124 PolarHBondContact O-N 3.38Å; S121-H124 PolarHBondContact OG-ND1 3.48Å
122	K	95.3	Very high	88.4	Confident	146 Å²	146	63.9 Å²	63.9	64%	0.635	36%	0.357	S	S	*	.	S	Bend	trans	-55.6	-40.2	-178.3	-177.4	-172.7	-179.9	-173.7	0	112.9	D15	D15-K122 WeakPolarHBondContact OD2-CD 3.28Å; D15-K122 IonicContact OD2-NZ 3.97Å; D15-K122 PolarHBondContact OD2-NZ 3.25Å
123	E	95.1	Very high	87.9	Confident	135 Å²	135	62.4 Å²	62.4	63%	0.631	34%	0.34	S	S	*	.	S	Bend	trans	-100.4	-12.7	-177	-55.7	-58.2	142.9	0	0	112.8	S121	S121-E123 PolarHBondContact O-N 2.85Å
124	H	94.9	Very high	87.1	Confident	91 Å²	91	59.5 Å²	59.5	42%	0.421	33%	0.325	S	S	.	.	S	Bend	trans	-123.5	95.3	-174.9	-59.1	93.5	0	0	0	110.8	Y97 S121	Y97-H124 HydrophobicContact CD1-CB 3.84Å; Y97-H124 AromaticContact CD1-CG 3.78Å; Y97-H124 AromaticContact CD1-ND1 3.69Å; Y97-H124 AromaticContact CE1-ND1 3.88Å; Y97-H124 HydrophobicContact CG-CB 4.21Å; Y97-H124 AromaticContact CG-CG 3.91Å; S121-H124 PolarHBondContact N-O 2.74Å; S121-H124 CarbonylContact O-C 3.52Å; S121-H124 PolarHBondContact O-N 3.38Å; S121-H124 PolarHBondContact OG-ND1 3.48Å
125	P	94.6	Very high	85.8	Confident	112 Å²	112	66.2 Å²	66.2	73%	0.727	35%	0.351	S	S	*	.			trans	-59.7	153.6	176.3	-22.6	33.1	0	0	0	112.6
126	Y	91.3	Very high	84.6	Confident	90 Å²	90	69 Å²	69	35%	0.353	35%	0.351	S	S	.	.			trans	-71.6	135.3	176.7	-179.7	-94.6	0	0	0	111.4	E118 A128 D131	E118-Y126 HydrophobicContact CB-CE2 4.35Å; Y126-A128 VanDerWaalsContact CE1-CA 3.49Å; Y126-A128 HydrophobicContact CE1-CB 3.81Å; Y126-D131 VanDerWaalsContact OH-CB 3.32Å; Y126-D131 WeakPolarHBondContact OH-CB 3.31Å; Y126-D131 PolarHBondContact OH-OD2 2.83Å
127	D	89.7	Confident	83.2	Confident	66 Å²	66	68.5 Å²	68.5	35%	0.353	35%	0.349	S	S	.	.			trans	-117.9	105.6	173.8	-178.7	-3	0	0	0	110	Q96 A129 K130	Q96-D127 PolarHBondContact NE2-O 2.9Å; Q96-D127 PolarHBondContact OE1-O 3.41Å; D127-A129 PolarHBondContact O-N 3.49Å; D127-A129 VanDerWaalsContact O-N 3.12Å; D127-A129 VanDerWaalsContact OD1-CB 3.26Å; D127-A129 WeakPolarHBondContact OD1-CB 3.13Å; D127-A129 PolarHBondContact OD1-N 3.4Å; D127-K130 HydrophobicContact CB-CD 4.17Å; D127-K130 HydrophobicContact CB-CG 4.33Å; D127-K130 PolarHBondContact O-N 3.37Å; D127-K130 VanDerWaalsContact O-N 3.16Å; D127-K130 VanDerWaalsContact OD2-CE 3.23Å; D127-K130 WeakPolarHBondContact OD2-CE 3.5Å; D127-K130 IonicContact OD2-NZ 3.62Å
128	A	84	Confident	81.4	Confident	50 Å²	50	72.7 Å²	72.7	41%	0.413	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-21.3	-179.7	0	0	0	0	0	113.6	Y126 K130 L134	Y126-A128 VanDerWaalsContact CE1-CA 3.49Å; Y126-A128 HydrophobicContact CE1-CB 3.81Å; A128-K130 PolarHBondContact O-N 3.19Å; A128-L134 HydrophobicContact CB-CD1 3.77Å; A128-L134 VanDerWaalsContact O-CD1 3.32Å; A128-L134 WeakPolarHBondContact O-CD1 3.35Å
129	A	81.1	Confident	79.4	Confident	62 Å²	62	76.2 Å²	76.2	51%	0.512	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-21.4	179.8	0	0	0	0	0	112.9	D127	D127-A129 PolarHBondContact O-N 3.49Å; D127-A129 VanDerWaalsContact O-N 3.12Å; D127-A129 VanDerWaalsContact OD1-CB 3.26Å; D127-A129 WeakPolarHBondContact OD1-CB 3.13Å; D127-A129 PolarHBondContact OD1-N 3.4Å
130	K	79.1	Confident	77.4	Confident	96 Å²	96	82.4 Å²	82.4	42%	0.417	43%	0.427	S	S	.	.	S	Bend	trans	-93.6	-13	-175.4	-63.8	-178.8	-178.5	175.1	0	114.3	E100 R103 D127 A128 S132	E100-K130 HydrophobicContact CG-CD 4.35Å; R103-K130 PolarHBondContact NH2-O 2.77Å; D127-K130 HydrophobicContact CB-CD 4.17Å; D127-K130 HydrophobicContact CB-CG 4.33Å; D127-K130 PolarHBondContact O-N 3.37Å; D127-K130 VanDerWaalsContact O-N 3.16Å; D127-K130 VanDerWaalsContact OD2-CE 3.23Å; D127-K130 WeakPolarHBondContact OD2-CE 3.5Å; D127-K130 IonicContact OD2-NZ 3.62Å; A128-K130 PolarHBondContact O-N 3.19Å; K130-S132 PolarHBondContact O-N 2.96Å
131	D	73.6	Confident	75.3	Confident	9 Å²	9	84.6 Å²	84.6	5%	0.048	43%	0.43	C	S	.	.			trans	-73.8	123	-172.9	-171.1	-43.2	0	0	0	111.8	Y126 I133 L134 R135	Y126-D131 VanDerWaalsContact OH-CB 3.32Å; Y126-D131 WeakPolarHBondContact OH-CB 3.31Å; Y126-D131 PolarHBondContact OH-OD2 2.83Å; D131-I133 VanDerWaalsContact C-N 3.33Å; D131-I133 PolarHBondContact O-N 2.73Å; D131-I133 WeakPolarHBondContact OD1-CA 3.23Å; D131-I133 VanDerWaalsContact OD1-CB 3.27Å; D131-I133 WeakPolarHBondContact OD1-CB 3.45Å; D131-I133 PolarHBondContact OD1-N 3.22Å; D131-L134 HydrophobicContact CB-CB 4.06Å; D131-L134 HydrophobicContact CB-CD1 3.93Å; D131-L134 HydrophobicContact CB-CG 4.23Å; D131-L134 PolarHBondContact O-N 2.99Å; D131-L134 PolarHBondContact OD1-N 3.48Å; D131-R135 WeakPolarHBondContact O-CG 3.26Å; D131-R135 PolarHBondContact O-N 2.93Å
132	S	66.7	Low	73.1	Confident	7 Å²	7	87.8 Å²	87.8	5%	0.049	45%	0.449	C	S	.	.	H	α-helix	trans	-65.5	-33.3	179.7	62.2	0	0	0	0	113	D107 E118 K130 R135 R136	D107-S132 WeakPolarHBondContact OD1-CB 3.44Å; E118-S132 PolarHBondContact OE1-OG 3.28Å; K130-S132 PolarHBondContact O-N 2.96Å; S132-R135 WeakPolarHBondContact O-CB 3.18Å; S132-R135 PolarHBondContact O-N 3.34Å; S132-R136 VanDerWaalsContact O-CG 3.27Å; S132-R136 WeakPolarHBondContact O-CG 3.32Å; S132-R136 PolarHBondContact O-N 3.39Å
133	I	68.6	Low	70.9	Confident	82 Å²	82	84.8 Å²	84.8	42%	0.421	45%	0.452	S	S	.	.	H	α-helix	trans	-70	-44.2	175.5	-64	174.6	0	0	0	109.5	V116 D131 R135 R136 A137	V116-I133 WeakPolarHBondContact O-CD1 3.47Å; D131-I133 VanDerWaalsContact C-N 3.33Å; D131-I133 PolarHBondContact O-N 2.73Å; D131-I133 WeakPolarHBondContact OD1-CA 3.23Å; D131-I133 VanDerWaalsContact OD1-CB 3.27Å; D131-I133 WeakPolarHBondContact OD1-CB 3.45Å; D131-I133 PolarHBondContact OD1-N 3.22Å; I133-R135 VanDerWaalsContact C-N 3.29Å; I133-R135 PolarHBondContact O-N 3.08Å; I133-R136 CarbonylContact O-C 3.56Å; I133-R136 PolarHBondContact O-N 3Å; I133-R136 VanDerWaalsContact O-N 3.08Å; I133-A137 WeakPolarHBondContact O-CB 3.32Å; I133-A137 PolarHBondContact O-N 2.94Å
134	L	65.8	Low	69	Low	34 Å²	34	85.6 Å²	85.6	18%	0.178	46%	0.455	C	S	.	.	H	α-helix	trans	-60.3	-40.6	173.7	-80.7	167.8	0	0	0	111.2	A128 D131 R136 A137 R138 L146	A128-L134 HydrophobicContact CB-CD1 3.77Å; A128-L134 VanDerWaalsContact O-CD1 3.32Å; A128-L134 WeakPolarHBondContact O-CD1 3.35Å; D131-L134 HydrophobicContact CB-CB 4.06Å; D131-L134 HydrophobicContact CB-CD1 3.93Å; D131-L134 HydrophobicContact CB-CG 4.23Å; D131-L134 PolarHBondContact O-N 2.99Å; D131-L134 PolarHBondContact OD1-N 3.48Å; L134-R136 VanDerWaalsContact C-N 3.31Å; L134-R136 PolarHBondContact O-N 3.35Å; L134-A137 CarbonylContact O-C 3.47Å; L134-A137 PolarHBondContact O-N 2.61Å; L134-R138 WeakPolarHBondContact O-CG 3.34Å; L134-R138 PolarHBondContact O-N 3.39Å; L134-L146 HydrophobicContact CD2-CD1 4.5Å; L134-L146 HydrophobicContact CD2-CD2 3.88Å
135	R	63.7	Low	67.1	Low	141 Å²	141	86.1 Å²	86.1	53%	0.532	46%	0.461	S	S	.	.	H	α-helix	trans	-58.6	-40.5	172.8	-74	171.7	60	-139.7	-2	112.5	D107 D131 S132 I133	D107-R135 IonicContact OD1-NH1 2.85Å; D107-R135 IonicContact OD2-NH1 3.04Å; D107-R135 PolarHBondContact OD2-NH1 2.97Å; D131-R135 WeakPolarHBondContact O-CG 3.26Å; D131-R135 PolarHBondContact O-N 2.93Å; S132-R135 WeakPolarHBondContact O-CB 3.18Å; S132-R135 PolarHBondContact O-N 3.34Å; I133-R135 VanDerWaalsContact C-N 3.29Å; I133-R135 PolarHBondContact O-N 3.08Å
136	R	64.8	Low	65.2	Low	104 Å²	104	86.2 Å²	86.2	39%	0.392	46%	0.455	S	S	.	.	H	α-helix	trans	-73.6	-32.3	176.5	-68.8	170.3	-167.2	-166	3.2	112.6	D107 H109 S132 I133 L134	D107-R136 VanDerWaalsContact CA-NH2 3.32Å; D107-R136 PolarHBondContact O-NH2 3.16Å; D107-R136 IonicContact OD1-NH2 2.68Å; D107-R136 PolarHBondContact OD1-NH2 3.12Å; H109-R136 PolarHBondContact O-NH1 3.38Å; S132-R136 VanDerWaalsContact O-CG 3.27Å; S132-R136 WeakPolarHBondContact O-CG 3.32Å; S132-R136 PolarHBondContact O-N 3.39Å; I133-R136 CarbonylContact O-C 3.56Å; I133-R136 PolarHBondContact O-N 3Å; I133-R136 VanDerWaalsContact O-N 3.08Å; L134-R136 VanDerWaalsContact C-N 3.31Å; L134-R136 PolarHBondContact O-N 3.35Å
137	A	62	Low	63.1	Low	9 Å²	9	94.9 Å²	94.9	7%	0.074	49%	0.487	C	S	.	.	H	α-helix	trans	-91.1	-2.1	-176.2	0	0	0	0	0	113.9	I133 L134 G139 M140 F141	I133-A137 WeakPolarHBondContact O-CB 3.32Å; I133-A137 PolarHBondContact O-N 2.94Å; L134-A137 CarbonylContact O-C 3.47Å; L134-A137 PolarHBondContact O-N 2.61Å; A137-G139 PolarHBondContact O-N 3.08Å; A137-M140 WeakPolarHBondContact O-CA 3.45Å; A137-M140 PolarHBondContact O-N 2.77Å; A137-F141 HydrophobicContact CB-CD2 3.64Å; A137-F141 HydrophobicContact CB-CE2 3.69Å; A137-F141 PolarHBondContact O-N 2.98Å; A137-F141 VanDerWaalsContact O-N 3.08Å
138	R	54.9	Low	61.7	Low	175 Å²	175	96.4 Å²	96.4	66%	0.66	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-9.7	172.7	-88.9	179.5	-164.7	-159.7	6.5	114.6	L134	L134-R138 WeakPolarHBondContact O-CG 3.34Å; L134-R138 PolarHBondContact O-N 3.39Å
139	G	53.2	Low	60.5	Low	81 Å²	81	98.8 Å²	98.8	84%	0.835	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-5.2	167.9	0	0	0	0	0	115.1	A137	A137-G139 PolarHBondContact O-N 3.08Å
140	M	54	Low	59.4	Low	158 Å²	158	100.8 Å²	100.8	78%	0.778	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	-22	-174.8	-58.9	-175	-158.3	0	0	113.4	A137	A137-M140 WeakPolarHBondContact O-CA 3.45Å; A137-M140 PolarHBondContact O-N 2.77Å
141	F	52.2	Low	58.2	Low	115 Å²	115	101.1 Å²	101.1	50%	0.504	50%	0.502	S	S	.	.	S	Bend	trans	-111.1	137.6	174.8	-64.8	-77.8	0	0	0	110.7	A137 D145	A137-F141 HydrophobicContact CB-CD2 3.64Å; A137-F141 HydrophobicContact CB-CE2 3.69Å; A137-F141 PolarHBondContact O-N 2.98Å; A137-F141 VanDerWaalsContact O-N 3.08Å; F141-D145 HydrophobicContact CD1-CB 4.3Å
142	T	49.7	Very low	57.3	Low	81 Å²	81	106.9 Å²	106.9	50%	0.497	53%	0.53	S	S	.	.			trans	-82.1	155.7	172.5	62.8	0	0	0	0	109.8	E144 D145	T142-E144 PolarHBondContact O-N 2.98Å; T142-D145 PolarHBondContact N-OD2 2.98Å; T142-D145 PolarHBondContact O-N 2.81Å; T142-D145 PolarHBondContact OG1-OD2 2.93Å
143	A	50	Low	56.7	Low	83 Å²	83	113.5 Å²	113.5	69%	0.686	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-8.1	179.6	0	0	0	0	0	114
144	E	54.2	Low	55.8	Low	151 Å²	151	115.8 Å²	115.8	71%	0.706	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-20.9	175.3	-70	177.4	154.2	0	0	113	T142 L146	T142-E144 PolarHBondContact O-N 2.98Å; E144-L146 VanDerWaalsContact C-N 3.33Å; E144-L146 PolarHBondContact O-N 3.49Å
145	D	56.3	Low	55	Low	102 Å²	102	122.1 Å²	122.1	55%	0.545	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.6	-9.4	-178.1	-58.5	-54.6	0	0	0	113.4	F141 T142	F141-D145 HydrophobicContact CD1-CB 4.3Å; T142-D145 PolarHBondContact N-OD2 2.98Å; T142-D145 PolarHBondContact O-N 2.81Å; T142-D145 PolarHBondContact OG1-OD2 2.93Å
146	L	54.6	Low	54.3	Low	114 Å²	114	120.5 Å²	120.5	60%	0.597	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	15.7	-174.7	-68.3	169.7	0	0	0	113.6	L134 E144	L134-L146 HydrophobicContact CD2-CD1 4.5Å; L134-L146 HydrophobicContact CD2-CD2 3.88Å; E144-L146 VanDerWaalsContact C-N 3.33Å; E144-L146 PolarHBondContact O-N 3.49Å
147	R	45.8	Very low	53.4	Low	273 Å²	273	122 Å²	122	100%	1.03	63%	0.629	S	S	*	*			trans	-102.1	0	178.5	-80.5	-172.6	176	145.7	0.6	113.2

Retrieved 147 of 147 residues in 93.1 ms (Link to these results)

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